tert-butyl 7-chloranyl-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate

Systemtic Name: tert-butyl 7-chloranyl-3-methyl-4-oxidanidyl-1-oxidanylidene-quinoxalin-1-ium-2-carboxylate Openeye Name: tert-butyl 7-chloro-3-methyl-4-oxido-1-oxo-quinoxalin-1-ium-2-carboxylate CAS Name: 7-chloro-3-methyl-4-oxido-1-oxo-2-quinoxalin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-chloro-3-methyl-4-oxido-1-oxoquinoxalin-1-ium-2-carboxylate Traditional Name: 7-chloro-1-keto-3-methyl-4-oxido-quinoxalin-1-ium-2-carboxylic acid tert-butyl ester Formula: C14H15ClN2O4 MolecularWeight: 310.7329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)C2=C(N1[O-])C=CC(=C2)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C([N+](=O)C2=C(N1[O-])C=CC(=C2)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H15ClN2O4/c1-8-12(13(18)21-14(2,3)4)17(20)11-7-9(15)5-6-10(11)16(8)19/h5-7H,1-4H3