N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide CAS Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1-(2-methyl-1-oxopropyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-1-isobutyryl-isonipecotamide Formula: C27H33N3O3 MolecularWeight: 447.56922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)C(=O)NCC(C2=CC=C(C=C2)OC)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)C(=O)NCC(C2=CC=C(C=C2)OC)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C27H33N3O3/c1-18(2)27(32)30-14-12-20(13-15-30)26(31)29-16-23(19-8-10-21(33-3)11-9-19)24-17-28-25-7-5-4-6-22(24)25/h4-11,17-18,20,23,28H,12-16H2,1-3H3,(H,29,31)