1-[3-(2,5-dimethoxyphenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrolidin-1-yl]propan-1-one

Systemtic Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrolidin-1-yl]propan-1-one Openeye Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(o-tolyl)piperazine-1-carbonyl]pyrrolidin-1-yl]propan-1-one CAS Name: 1-[3-(2,5-dimethoxyphenyl)-4-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-1-propanone IUPAC Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-1-yl]propan-1-one Traditional Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(o-tolyl)piperazine-1-carbonyl]pyrrolidino]propan-1-one Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CC(C(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3C)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCC(=O)N1CC(C(C1)C(=O)N2CCN(CC2)C3=CC=CC=C3C)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C27H35N3O4/c1-5-26(31)30-17-22(21-16-20(33-3)10-11-25(21)34-4)23(18-30)27(32)29-14-12-28(13-15-29)24-9-7-6-8-19(24)2/h6-11,16,22-23H,5,12-15,17-18H2,1-4H3