(4S)-1-(2-methylphenyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: (4S)-1-(2-methylphenyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: (4S)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-(o-tolyl)pyrrolidin-2-one CAS Name: (4S)-1-(2-methylphenyl)-4-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]-2-pyrrolidinone IUPAC Name: (4S)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-(2-methylphenyl)pyrrolidin-2-one Traditional Name: (4S)-4-(4-benzylpiperazin-4-ium-1-carbonyl)-1-(o-tolyl)-2-pyrrolidone Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2/c1-18-7-5-6-10-21(18)26-17-20(15-22(26)27)23(28)25-13-11-24(12-14-25)16-19-8-3-2-4-9-19/h2-10,20H,11-17H2,1H3/p+1/t20-/m0/s1