(3R)-3-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-dione

Systemtic Name: (3R)-3-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-dione Openeye Name: (3R)-3-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-dione CAS Name: (3R)-3-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-dione IUPAC Name: (3R)-3-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-dione Traditional Name: (3R)-3-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)amino]-1-(4-ethylphenyl)pyrrolidine-2,5-quinone Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)CC(C2=O)NC3=[N+](C4=CC=CC=C4N3)CC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)NC3=[N+](C4=CC=CC=C4N3)CC

InChI

InChI=1S/C21H22N4O2/c1-3-14-9-11-15(12-10-14)25-19(26)13-17(20(25)27)23-21-22-16-7-5-6-8-18(16)24(21)4-2/h5-12,17H,3-4,13H2,1-2H3,(H,22,23)/p+1/t17-/m1/s1