ethyl 6,8-dimethyl-4-[(5-nitro-2-oxidanyl-phenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6,8-dimethyl-4-[(5-nitro-2-oxidanyl-phenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 4-(2-hydroxy-5-nitro-anilino)-6,8-dimethyl-quinoline-3-carboxylate CAS Name: 4-(2-hydroxy-5-nitroanilino)-6,8-dimethyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-hydroxy-5-nitroanilino)-6,8-dimethylquinoline-3-carboxylate Traditional Name: 4-(2-hydroxy-5-nitro-anilino)-6,8-dimethyl-quinoline-3-carboxylic acid ethyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)C)NC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=CC(=C2N=C1)C)C)NC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H19N3O5/c1-4-28-20(25)15-10-21-18-12(3)7-11(2)8-14(18)19(15)22-16-9-13(23(26)27)5-6-17(16)24/h5-10,24H,4H2,1-3H3,(H,21,22)