1-(3,4-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(3,4-dimethylphenyl)-N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)-N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)-N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(CCN(C4)C(=O)C(C)C)C=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(CCN(C4)C(=O)C(C)C)C=C3)C

InChI

InChI=1S/C26H31N3O3/c1-16(2)26(32)28-10-9-19-6-7-22(12-20(19)14-28)27-25(31)21-13-24(30)29(15-21)23-8-5-17(3)18(4)11-23/h5-8,11-12,16,21H,9-10,13-15H2,1-4H3,(H,27,31)