4-[(5-carboxy-2-methyl-phenyl)amino]-6,8-bis(chloranyl)quinoline-3-carboxylic acid

Systemtic Name: 4-[(5-carboxy-2-methyl-phenyl)amino]-6,8-bis(chloranyl)quinoline-3-carboxylic acid Openeye Name: 4-(5-carboxy-2-methyl-anilino)-6,8-dichloro-quinoline-3-carboxylic acid CAS Name: 4-(5-carboxy-2-methylanilino)-6,8-dichloro-3-quinolinecarboxylic acid IUPAC Name: 4-(5-carboxy-2-methylanilino)-6,8-dichloroquinoline-3-carboxylic acid Traditional Name: 4-(5-carboxy-2-methyl-anilino)-6,8-dichloro-quinoline-3-carboxylic acid Formula: C18H12Cl2N2O4 MolecularWeight: 391.20488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=C(C=NC3=C(C=C(C=C32)Cl)Cl)C(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=C(C=NC3=C(C=C(C=C32)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H12Cl2N2O4/c1-8-2-3-9(17(23)24)4-14(8)22-15-11-5-10(19)6-13(20)16(11)21-7-12(15)18(25)26/h2-7H,1H3,(H,21,22)(H,23,24)(H,25,26)