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

Systemtic Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]propan-1-one Openeye Name: 1-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]propan-1-one CAS Name: 1-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-4-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-1-propanone IUPAC Name: 1-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]propan-1-one Traditional Name: 1-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-(2,5-dimethoxyphenyl)pyrrolidino]propan-1-one Formula: C25H30N2O4 MolecularWeight: 422.5167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N2O4/c1-4-24(28)27-15-21(20-13-19(30-2)9-10-23(20)31-3)22(16-27)25(29)26-12-11-17-7-5-6-8-18(17)14-26/h5-10,13,21-22H,4,11-12,14-16H2,1-3H3