dimethyl 7-chloranyl-1-ethyl-4-oxidanyl-4a,5-dihydropyridazino[4,3-b]quinoxaline-3,4-dicarboxylate

Systemtic Name: dimethyl 7-chloranyl-1-ethyl-4-oxidanyl-4a,5-dihydropyridazino[4,3-b]quinoxaline-3,4-dicarboxylate Openeye Name: dimethyl 7-chloro-1-ethyl-4-hydroxy-4a,5-dihydropyridazino[4,3-b]quinoxaline-3,4-dicarboxylate CAS Name: 7-chloro-1-ethyl-4-hydroxy-4a,5-dihydropyridazino[4,3-b]quinoxaline-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-chloro-1-ethyl-4-hydroxy-4a,5-dihydropyridazino[4,3-b]quinoxaline-3,4-dicarboxylate Traditional Name: 7-chloro-1-ethyl-4-hydroxy-4a,5-dihydropyridazino[4,3-b]quinoxaline-3,4-dicarboxylic acid dimethyl ester Formula: C16H17ClN4O5 MolecularWeight: 380.78298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC3=C(C=C(C=C3)Cl)NC2C(C(=N1)C(=O)OC)(C(=O)OC)O

Isomeric SMILES

CCN1C2=NC3=C(C=C(C=C3)Cl)NC2C(C(=N1)C(=O)OC)(C(=O)OC)O

InChI

InChI=1S/C16H17ClN4O5/c1-4-21-13-11(18-10-7-8(17)5-6-9(10)19-13)16(24,15(23)26-3)12(20-21)14(22)25-2/h5-7,11,18,24H,4H2,1-3H3