(3S)-N-[(3,4-dimethoxyphenyl)methyl]-1-(1H-indol-2-ylcarbonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[(3,4-dimethoxyphenyl)methyl]-1-(1H-indol-2-ylcarbonyl)piperidine-3-carboxamide Openeye Name: (3S)-N-[(3,4-dimethoxyphenyl)methyl]-1-(1H-indole-2-carbonyl)piperidine-3-carboxamide CAS Name: (3S)-N-[(3,4-dimethoxyphenyl)methyl]-1-[1H-indol-2-yl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: (3S)-N-[(3,4-dimethoxyphenyl)methyl]-1-(1H-indole-2-carbonyl)piperidine-3-carboxamide Traditional Name: (3S)-1-(1H-indole-2-carbonyl)-N-veratryl-nipecotamide Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2CCCN(C2)C(=O)C3=CC4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)[C@H]2CCCN(C2)C(=O)C3=CC4=CC=CC=C4N3)OC

InChI

InChI=1S/C24H27N3O4/c1-30-21-10-9-16(12-22(21)31-2)14-25-23(28)18-7-5-11-27(15-18)24(29)20-13-17-6-3-4-8-19(17)26-20/h3-4,6,8-10,12-13,18,26H,5,7,11,14-15H2,1-2H3,(H,25,28)/t18-/m0/s1