N-[1-benzofuran-2-yl(phenyl)methyl]-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-benzofuran-2-yl(phenyl)methyl]-1-(2-methylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[benzofuran-2-yl(phenyl)methyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide CAS Name: N-[2-benzofuranyl(phenyl)methyl]-1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[1-benzofuran-2-yl(phenyl)methyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide Traditional Name: N-[benzofuran-2-yl(phenyl)methyl]-1-o-toluoyl-isonipecotamide Formula: C29H28N2O3 MolecularWeight: 452.54422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC(C3=CC=CC=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NC(C3=CC=CC=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C29H28N2O3/c1-20-9-5-7-13-24(20)29(33)31-17-15-22(16-18-31)28(32)30-27(21-10-3-2-4-11-21)26-19-23-12-6-8-14-25(23)34-26/h2-14,19,22,27H,15-18H2,1H3,(H,30,32)