methyl 6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-3-prop-2-enyl-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-3-prop-2-enyl-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 3-allyl-6,7-dimethyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 6,7-dimethyl-4-oxido-1-oxo-3-prop-2-enyl-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 6,7-dimethyl-4-oxido-1-oxo-3-prop-2-enylquinoxalin-1-ium-2-carboxylate Traditional Name: 3-allyl-1-keto-6,7-dimethyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O4/c1-5-6-11-14(15(18)21-4)17(20)13-8-10(3)9(2)7-12(13)16(11)19/h5,7-8H,1,6H2,2-4H3