(3S)-1-(3-methylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-1-(3-methylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(4-methylpiperazine-1,4-diium-1-yl)-1-(m-tolyl)pyrrolidine-2,5-dione CAS Name: (3S)-1-(3-methylphenyl)-3-(4-methyl-1-piperazine-1,4-diiumyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-1-(3-methylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-(4-methylpiperazine-1,4-diium-1-yl)-1-(m-tolyl)pyrrolidine-2,5-quinone Formula: C16H23N3O2+2 MolecularWeight: 289.37272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)CC(C2=O)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C[C@@H](C2=O)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C16H21N3O2/c1-12-4-3-5-13(10-12)19-15(20)11-14(16(19)21)18-8-6-17(2)7-9-18/h3-5,10,14H,6-9,11H2,1-2H3/p+2/t14-/m0/s1