N-[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[(3S)-5-oxo-1-phenyl-pyrrolidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[(3S)-5-oxo-1-phenyl-3-pyrrolidinyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[(3S)-5-oxo-1-phenylpyrrolidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[(3S)-5-keto-1-phenyl-pyrrolidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C20H21N3O2 MolecularWeight: 335.39964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)NC3CC(=O)N(C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)N[C@H]3CC(=O)N(C3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O2/c24-19-12-17(14-23(19)18-8-2-1-3-9-18)21-20(25)22-11-10-15-6-4-5-7-16(15)13-22/h1-9,17H,10-14H2,(H,21,25)/t17-/m0/s1