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Compound Report Overview

Compound Name: BUTINOLINE
Compound Identifier: 701342
Mol Structure 2D: 701342
Molecular Weight: 291
Formula: C20 H21 N O
Development Status: Preclinical
SMILES: OC(C#CCN1CCCC1)(c2ccccc2)c3ccccc3
Compound Structures
>^ ISISHOST06100222322D 0 0.00000 0.00000 0^^ 22 24 0 0 0 999 V2000^ -0.9000 0.3333 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.2667 0.3333 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4000 0.3333 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1125 1.2750 0.0000 N 0 0 3 0 0 0 0 0 0^ -2.0583 0.3208 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9083 -0.8292 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5375 0.3333 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9000 1.4500 0.0000 O 0 0 0 0 0 0 0 0 0^ 4.2167 1.5125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5542 2.2833 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0375 -1.4125 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6208 1.3083 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6458 -0.6417 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9125 -1.4000 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3417 2.6625 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3042 3.1208 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.7583 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.7833 -0.6542 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9125 -2.5167 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0500 -2.5542 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 0.3333 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9333 -3.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 2 3 0 0 0^ 4 7 1 0 0 0^ 5 1 1 0 0 0^ 6 1 1 0 0 0^ 7 3 1 0 0 0^ 8 1 1 0 0 0^ 9 4 1 0 0 0^ 10 4 1 0 0 0^ 11 6 1 0 0 0^ 12 5 2 0 0 0^ 13 5 1 0 0 0^ 14 6 2 0 0 0^ 15 9 1 0 0 0^ 16 10 1 0 0 0^ 17 12 1 0 0 0^ 18 13 2 0 0 0^ 19 14 1 0 0 0^ 20 11 2 0 0 0^ 21 18 1 0 0 0^ 22 19 2 0 0 0^ 22 20 1 0 0 0^ 21 17 2 0 0 0^ 16 15 1 0 0 0^M END^^
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