(phenylmethyl) N-[(2S)-3-methyl-1-[4-(3-methylphenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-3-methyl-1-[4-(3-methylphenyl)piperazin-1-yl]-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-methyl-1-[4-(m-tolyl)piperazine-1-carbonyl]propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-[4-(3-methylphenyl)-1-piperazinyl]-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-3-methyl-1-[4-(3-methylphenyl)piperazin-1-yl]-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-2-methyl-1-[4-(m-tolyl)piperazine-1-carbonyl]propyl]carbamic acid benzyl ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)[C@H](C(C)C)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O3/c1-18(2)22(25-24(29)30-17-20-9-5-4-6-10-20)23(28)27-14-12-26(13-15-27)21-11-7-8-19(3)16-21/h4-11,16,18,22H,12-15,17H2,1-3H3,(H,25,29)/t22-/m0/s1