methyl 7-methyl-4-oxidanidyl-1-oxidanylidene-3-(phenylmethyl)quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 7-methyl-4-oxidanidyl-1-oxidanylidene-3-(phenylmethyl)quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 3-benzyl-7-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 7-methyl-4-oxido-1-oxo-3-(phenylmethyl)-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-benzyl-7-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 3-benzyl-1-keto-7-methyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C([N+]2=O)C(=O)OC)CC3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C([N+]2=O)C(=O)OC)CC3=CC=CC=C3)[O-]

InChI

InChI=1S/C18H16N2O4/c1-12-8-9-14-15(10-12)20(23)17(18(21)24-2)16(19(14)22)11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3