N-[2-[1-[2-(azepan-1-yl)ethyl]indol-3-yl]ethyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[2-[1-[2-(azepan-1-yl)ethyl]indol-3-yl]ethyl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[1-[2-(azepan-1-yl)ethyl]indol-3-yl]ethyl]-3,5-dimethyl-benzamide CAS Name: N-[2-[1-[2-(1-azepanyl)ethyl]-3-indolyl]ethyl]-3,5-dimethylbenzamide IUPAC Name: N-[2-[1-[2-(azepan-1-yl)ethyl]indol-3-yl]ethyl]-3,5-dimethylbenzamide Traditional Name: N-[2-[1-[2-(azepan-1-yl)ethyl]indol-3-yl]ethyl]-3,5-dimethyl-benzamide Formula: C27H35N3O MolecularWeight: 417.5863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCCC2=CN(C3=CC=CC=C32)CCN4CCCCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCCC2=CN(C3=CC=CC=C32)CCN4CCCCCC4)C

InChI

InChI=1S/C27H35N3O/c1-21-17-22(2)19-24(18-21)27(31)28-12-11-23-20-30(26-10-6-5-9-25(23)26)16-15-29-13-7-3-4-8-14-29/h5-6,9-10,17-20H,3-4,7-8,11-16H2,1-2H3,(H,28,31)