azepan-1-yl-[3-[[4-(2,6-dimethylphenyl)piperidin-1-yl]methyl]-1H-indol-2-yl]methanone

Systemtic Name: azepan-1-yl-[3-[[4-(2,6-dimethylphenyl)piperidin-1-yl]methyl]-1H-indol-2-yl]methanone Openeye Name: azepan-1-yl-[3-[[4-(2,6-dimethylphenyl)-1-piperidyl]methyl]-1H-indol-2-yl]methanone CAS Name: 1-azepanyl-[3-[[4-(2,6-dimethylphenyl)-1-piperidinyl]methyl]-1H-indol-2-yl]methanone IUPAC Name: azepan-1-yl-[3-[[4-(2,6-dimethylphenyl)piperidin-1-yl]methyl]-1H-indol-2-yl]methanone Traditional Name: azepan-1-yl-[3-[[4-(2,6-dimethylphenyl)piperidino]methyl]-1H-indol-2-yl]methanone Formula: C29H37N3O MolecularWeight: 443.62358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2CCN(CC2)CC3=C(NC4=CC=CC=C43)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2CCN(CC2)CC3=C(NC4=CC=CC=C43)C(=O)N5CCCCCC5

InChI

InChI=1S/C29H37N3O/c1-21-10-9-11-22(2)27(21)23-14-18-31(19-15-23)20-25-24-12-5-6-13-26(24)30-28(25)29(33)32-16-7-3-4-8-17-32/h5-6,9-13,23,30H,3-4,7-8,14-20H2,1-2H3