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

Systemtic Name: 3,3-dimethyl-1-[3-(4-methylphenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]carbonyl-pyrrolidin-1-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[3-[4-(o-tolyl)piperazine-1-carbonyl]-4-(p-tolyl)pyrrolidin-1-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[3-(4-methylphenyl)-4-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[3-(4-methylphenyl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-1-yl]butan-1-one Traditional Name: 3,3-dimethyl-1-[3-[4-(o-tolyl)piperazine-1-carbonyl]-4-(p-tolyl)pyrrolidino]butan-1-one Formula: C29H39N3O2 MolecularWeight: 461.63886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C(=O)CC(C)(C)C

InChI

InChI=1S/C29H39N3O2/c1-21-10-12-23(13-11-21)24-19-32(27(33)18-29(3,4)5)20-25(24)28(34)31-16-14-30(15-17-31)26-9-7-6-8-22(26)2/h6-13,24-25H,14-20H2,1-5H3