N-(3,4-dimethylphenyl)-4-(3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)-2,4-bis(oxidanylidene)butanamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-yl)-2,4-bis(oxidanylidene)butanamide Openeye Name: N-(3,4-dimethylphenyl)-4-(3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-yl)-2,4-dioxo-butanamide CAS Name: N-(3,4-dimethylphenyl)-4-(3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumyl)-2,4-dioxobutanamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-yl)-2,4-dioxobutanamide Traditional Name: N-(3,4-dimethylphenyl)-2,4-diketo-4-(1-keto-3-methyl-4-oxido-quinoxalin-1-ium-2-yl)butyramide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=O)CC(=O)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(=O)CC(=O)C2=C(N(C3=CC=CC=C3[N+]2=O)[O-])C)C

InChI

InChI=1S/C21H19N3O5/c1-12-8-9-15(10-13(12)2)22-21(27)19(26)11-18(25)20-14(3)23(28)16-6-4-5-7-17(16)24(20)29/h4-10H,11H2,1-3H3,(H,22,27)