6,7-dimethoxy-N-[(2S)-1-oxidanylidene-3-phenyl-1-pyrrolidin-1-yl-propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 6,7-dimethoxy-N-[(2S)-1-oxidanylidene-3-phenyl-1-pyrrolidin-1-yl-propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-pyrrolidin-1-yl-ethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 6,7-dimethoxy-N-[(2S)-1-oxo-3-phenyl-1-(1-pyrrolidinyl)propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 6,7-dimethoxy-N-[(2S)-1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-pyrrolidino-ethyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)NC(CC3=CC=CC=C3)C(=O)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N4CCCC4)OC

InChI

InChI=1S/C25H31N3O4/c1-31-22-15-19-10-13-28(17-20(19)16-23(22)32-2)25(30)26-21(14-18-8-4-3-5-9-18)24(29)27-11-6-7-12-27/h3-5,8-9,15-16,21H,6-7,10-14,17H2,1-2H3,(H,26,30)/t21-/m0/s1