(3S)-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: (3S)-N-[(S)-(4-methoxyphenyl)-phenylmethyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[(S)-(4-methoxyphenyl)-phenylmethyl]-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-1-phenethyl-pyrrolidine-3-carboxamide Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)C3CC(=O)N(C3)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NC(=O)[C@H]3CC(=O)N(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O3/c1-32-24-14-12-22(13-15-24)26(21-10-6-3-7-11-21)28-27(31)23-18-25(30)29(19-23)17-16-20-8-4-2-5-9-20/h2-15,23,26H,16-19H2,1H3,(H,28,31)/t23-,26-/m0/s1