1-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-4-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-3-methyl-1-butanone IUPAC Name: 1-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidino]-3-methyl-butan-1-one Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CC(C(C1)C(=O)N2CCC3=CC=CC=C3C2)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC(C)CC(=O)N1CC(C(C1)C(=O)N2CCC3=CC=CC=C3C2)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C27H34N2O4/c1-18(2)13-26(30)29-16-23(22-14-21(32-3)9-10-25(22)33-4)24(17-29)27(31)28-12-11-19-7-5-6-8-20(19)15-28/h5-10,14,18,23-24H,11-13,15-17H2,1-4H3