7-chloranyl-8-methyl-4-[(5-nitro-2-oxidanyl-phenyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 7-chloranyl-8-methyl-4-[(5-nitro-2-oxidanyl-phenyl)amino]quinoline-3-carboxylic acid Openeye Name: 7-chloro-4-(2-hydroxy-5-nitro-anilino)-8-methyl-quinoline-3-carboxylic acid CAS Name: 7-chloro-4-(2-hydroxy-5-nitroanilino)-8-methyl-3-quinolinecarboxylic acid IUPAC Name: 7-chloro-4-(2-hydroxy-5-nitroanilino)-8-methylquinoline-3-carboxylic acid Traditional Name: 7-chloro-4-(2-hydroxy-5-nitro-anilino)-8-methyl-quinoline-3-carboxylic acid Formula: C17H12ClN3O5 MolecularWeight: 373.74728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C(C(=CN=C12)C(=O)O)NC3=C(C=CC(=C3)[N+](=O)[O-])O)Cl

Isomeric SMILES

CC1=C(C=CC2=C(C(=CN=C12)C(=O)O)NC3=C(C=CC(=C3)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C17H12ClN3O5/c1-8-12(18)4-3-10-15(8)19-7-11(17(23)24)16(10)20-13-6-9(21(25)26)2-5-14(13)22/h2-7,22H,1H3,(H,19,20)(H,23,24)