methyl 4-(3-cyano-6,7-dimethyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)benzoate

Systemtic Name: methyl 4-(3-cyano-6,7-dimethyl-1-oxidanidyl-4-oxidanylidene-quinoxalin-4-ium-2-yl)benzoate Openeye Name: methyl 4-(3-cyano-6,7-dimethyl-1-oxido-4-oxo-quinoxalin-4-ium-2-yl)benzoate CAS Name: 4-(3-cyano-6,7-dimethyl-1-oxido-4-oxo-2-quinoxalin-4-iumyl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-cyano-6,7-dimethyl-1-oxido-4-oxoquinoxalin-4-ium-2-yl)benzoate Traditional Name: 4-(3-cyano-4-keto-6,7-dimethyl-1-oxido-quinoxalin-4-ium-2-yl)benzoic acid methyl ester Formula: C19H15N3O4 MolecularWeight: 349.3401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=O)C(=C(N2[O-])C3=CC=C(C=C3)C(=O)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=O)C(=C(N2[O-])C3=CC=C(C=C3)C(=O)OC)C#N

InChI

InChI=1S/C19H15N3O4/c1-11-8-15-16(9-12(11)2)22(25)18(17(10-20)21(15)24)13-4-6-14(7-5-13)19(23)26-3/h4-9H,1-3H3