1-[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylpyrrolidin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylpyrrolidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[2-(4-benzhydrylpiperazine-1-carbonyl)pyrrolidin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-butanone IUPAC Name: 1-[2-(4-benzhydrylpiperazine-1-carbonyl)pyrrolidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[2-(4-benzhydrylpiperazine-1-carbonyl)pyrrolidino]-3-methyl-butan-1-one Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCCC1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)N1CCCC1C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O2/c1-21(2)20-25(31)30-15-9-14-24(30)27(32)29-18-16-28(17-19-29)26(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-8,10-13,21,24,26H,9,14-20H2,1-2H3