N-(1,3-benzodioxol-5-yl)-1-[1-(phenylmethyl)indol-3-yl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[1-(phenylmethyl)indol-3-yl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(1-benzylindole-3-carbonyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[oxo-[1-(phenylmethyl)-3-indolyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(1-benzylindole-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(1-benzylindole-3-carbonyl)isonipecotamide Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCO3)C(=O)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C29H27N3O4/c33-28(30-22-10-11-26-27(16-22)36-19-35-26)21-12-14-31(15-13-21)29(34)24-18-32(17-20-6-2-1-3-7-20)25-9-5-4-8-23(24)25/h1-11,16,18,21H,12-15,17,19H2,(H,30,33)