[1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate

Systemtic Name: [1-[(4-methoxy-2-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate Openeye Name: [2-(4-methoxy-2-nitro-anilino)-1-methyl-2-oxo-ethyl] 2,3-dimethylquinoxaline-6-carboxylate CAS Name: 2,3-dimethyl-6-quinoxalinecarboxylic acid [1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methoxy-2-nitroanilino)-1-oxopropan-2-yl] 2,3-dimethylquinoxaline-6-carboxylate Traditional Name: 2,3-dimethylquinoxaline-6-carboxylic acid [2-keto-2-(4-methoxy-2-nitro-anilino)-1-methyl-ethyl] ester Formula: C21H20N4O6 MolecularWeight: 424.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)OC(C)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-])N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)OC(C)C(=O)NC3=C(C=C(C=C3)OC)[N+](=O)[O-])N=C1C

InChI

InChI=1S/C21H20N4O6/c1-11-12(2)23-18-9-14(5-7-16(18)22-11)21(27)31-13(3)20(26)24-17-8-6-15(30-4)10-19(17)25(28)29/h5-10,13H,1-4H3,(H,24,26)