methyl 3-tert-butyl-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: methyl 3-tert-butyl-6,7-dimethyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: methyl 3-tert-butyl-6,7-dimethyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 3-tert-butyl-6,7-dimethyl-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 3-tert-butyl-6,7-dimethyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 3-tert-butyl-1-keto-6,7-dimethyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid methyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4/c1-9-7-11-12(8-10(9)2)18(21)14(16(3,4)5)13(17(11)20)15(19)22-6/h7-8H,1-6H3