O3-ethyl O6-methyl 4-[(5-nitro-2-oxidanyl-phenyl)amino]quinoline-3,6-dicarboxylate

Systemtic Name: O3-ethyl O6-methyl 4-[(5-nitro-2-oxidanyl-phenyl)amino]quinoline-3,6-dicarboxylate Openeye Name: O3-ethyl O6-methyl 4-(2-hydroxy-5-nitro-anilino)quinoline-3,6-dicarboxylate CAS Name: 4-(2-hydroxy-5-nitroanilino)quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-methyl ester IUPAC Name: 3-O-ethyl 6-O-methyl 4-(2-hydroxy-5-nitroanilino)quinoline-3,6-dicarboxylate Traditional Name: 4-(2-hydroxy-5-nitro-anilino)quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-methyl ester Formula: C20H17N3O7 MolecularWeight: 411.36488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=C(C=CC(=C3)[N+](=O)[O-])O)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=C(C=CC(=C3)[N+](=O)[O-])O)C(=O)OC

InChI

InChI=1S/C20H17N3O7/c1-3-30-20(26)14-10-21-15-6-4-11(19(25)29-2)8-13(15)18(14)22-16-9-12(23(27)28)5-7-17(16)24/h4-10,24H,3H2,1-2H3,(H,21,22)