(3R)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-dione

Systemtic Name: (3R)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-dione Openeye Name: (3R)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-dione CAS Name: (3R)-1-[[4-(4-nitrophenyl)-1-piperazin-1-iumyl]methyl]-3-phenylpyrrolidine-2,5-dione IUPAC Name: (3R)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-phenylpyrrolidine-2,5-dione Traditional Name: (3R)-1-[[4-(4-nitrophenyl)piperazin-1-ium-1-yl]methyl]-3-phenyl-pyrrolidine-2,5-quinone Formula: C21H23N4O4+ MolecularWeight: 395.43172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)CC(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C[C@@H](C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O4/c26-20-14-19(16-4-2-1-3-5-16)21(27)24(20)15-22-10-12-23(13-11-22)17-6-8-18(9-7-17)25(28)29/h1-9,19H,10-15H2/p+1/t19-/m1/s1