2-methyl-1-[(3S)-3-[4-(2-methylphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[(3S)-3-[4-(2-methylphenyl)piperazin-1-yl]carbonylpiperidin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[(3S)-3-[4-(o-tolyl)piperazine-1-carbonyl]-1-piperidyl]propan-1-one CAS Name: 2-methyl-1-[(3S)-3-[[4-(2-methylphenyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-1-propanone IUPAC Name: 2-methyl-1-[(3S)-3-[4-(2-methylphenyl)piperazine-1-carbonyl]piperidin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[(3S)-3-[4-(o-tolyl)piperazine-1-carbonyl]piperidino]propan-1-one Formula: C21H31N3O2 MolecularWeight: 357.48974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3CCCN(C3)C(=O)C(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)[C@H]3CCCN(C3)C(=O)C(C)C

InChI

InChI=1S/C21H31N3O2/c1-16(2)20(25)24-10-6-8-18(15-24)21(26)23-13-11-22(12-14-23)19-9-5-4-7-17(19)3/h4-5,7,9,16,18H,6,8,10-15H2,1-3H3/t18-/m0/s1