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

Systemtic Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrolidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(o-tolyl)piperazine-1-carbonyl]pyrrolidin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3-(2,5-dimethoxyphenyl)-4-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-butanone IUPAC Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[3-(2,5-dimethoxyphenyl)-4-[4-(o-tolyl)piperazine-1-carbonyl]pyrrolidino]-3-methyl-butan-1-one Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CN(CC3C4=C(C=CC(=C4)OC)OC)C(=O)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CN(CC3C4=C(C=CC(=C4)OC)OC)C(=O)CC(C)C

InChI

InChI=1S/C29H39N3O4/c1-20(2)16-28(33)32-18-24(23-17-22(35-4)10-11-27(23)36-5)25(19-32)29(34)31-14-12-30(13-15-31)26-9-7-6-8-21(26)3/h6-11,17,20,24-25H,12-16,18-19H2,1-5H3