7-chloranyl-8-methyl-4-[(4-oxidanyl-4-oxidanylidene-butyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 7-chloranyl-8-methyl-4-[(4-oxidanyl-4-oxidanylidene-butyl)amino]quinoline-3-carboxylic acid Openeye Name: 7-chloro-4-[(4-hydroxy-4-oxo-butyl)amino]-8-methyl-quinoline-3-carboxylic acid CAS Name: 7-chloro-4-[(4-hydroxy-4-oxobutyl)amino]-8-methyl-3-quinolinecarboxylic acid IUPAC Name: 7-chloro-4-[(4-hydroxy-4-oxobutyl)amino]-8-methylquinoline-3-carboxylic acid Traditional Name: 7-chloro-4-[(4-hydroxy-4-keto-butyl)amino]-8-methyl-quinoline-3-carboxylic acid Formula: C15H15ClN2O4 MolecularWeight: 322.7436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C(C(=CN=C12)C(=O)O)NCCCC(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC2=C(C(=CN=C12)C(=O)O)NCCCC(=O)O)Cl

InChI

InChI=1S/C15H15ClN2O4/c1-8-11(16)5-4-9-13(8)18-7-10(15(21)22)14(9)17-6-2-3-12(19)20/h4-5,7H,2-3,6H2,1H3,(H,17,18)(H,19,20)(H,21,22)