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

Systemtic Name: 1-[3-(4-methylphenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrolidin-1-yl]propan-1-one Openeye Name: 1-[3-[4-(o-tolyl)piperazine-1-carbonyl]-4-(p-tolyl)pyrrolidin-1-yl]propan-1-one CAS Name: 1-[3-(4-methylphenyl)-4-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-1-propanone IUPAC Name: 1-[3-(4-methylphenyl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-1-yl]propan-1-one Traditional Name: 1-[3-[4-(o-tolyl)piperazine-1-carbonyl]-4-(p-tolyl)pyrrolidino]propan-1-one Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O2/c1-4-25(30)29-17-22(21-11-9-19(2)10-12-21)23(18-29)26(31)28-15-13-27(14-16-28)24-8-6-5-7-20(24)3/h5-12,22-23H,4,13-18H2,1-3H3