N-[1-[2-(azepan-1-yl)ethyl]piperidin-4-yl]-4-(2,2-dimethylpropoxy)-1H-indole-2-carboxamide

Systemtic Name: N-[1-[2-(azepan-1-yl)ethyl]piperidin-4-yl]-4-(2,2-dimethylpropoxy)-1H-indole-2-carboxamide Openeye Name: N-[1-[2-(azepan-1-yl)ethyl]-4-piperidyl]-4-(2,2-dimethylpropoxy)-1H-indole-2-carboxamide CAS Name: N-[1-[2-(1-azepanyl)ethyl]-4-piperidinyl]-4-(2,2-dimethylpropoxy)-1H-indole-2-carboxamide IUPAC Name: N-[1-[2-(azepan-1-yl)ethyl]piperidin-4-yl]-4-(2,2-dimethylpropoxy)-1H-indole-2-carboxamide Traditional Name: N-[1-[2-(azepan-1-yl)ethyl]-4-piperidyl]-4-neopentyloxy-1H-indole-2-carboxamide Formula: C27H42N4O2 MolecularWeight: 454.64798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=CC=CC2=C1C=C(N2)C(=O)NC3CCN(CC3)CCN4CCCCCC4

Isomeric SMILES

CC(C)(C)COC1=CC=CC2=C1C=C(N2)C(=O)NC3CCN(CC3)CCN4CCCCCC4

InChI

InChI=1S/C27H42N4O2/c1-27(2,3)20-33-25-10-8-9-23-22(25)19-24(29-23)26(32)28-21-11-15-31(16-12-21)18-17-30-13-6-4-5-7-14-30/h8-10,19,21,29H,4-7,11-18,20H2,1-3H3,(H,28,32)