7-chloranyl-3-methoxycarbonyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid

Systemtic Name: 7-chloranyl-3-methoxycarbonyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid Openeye Name: 7-chloro-3-methoxycarbonyl-4-oxo-1H-quinoline-2-carboxylic acid CAS Name: 7-chloro-3-methoxycarbonyl-4-oxo-1H-quinoline-2-carboxylic acid IUPAC Name: 7-chloro-3-methoxycarbonyl-4-oxo-1H-quinoline-2-carboxylic acid Traditional Name: 3-carbomethoxy-7-chloro-4-keto-1H-quinoline-2-carboxylic acid Formula: C12H8ClNO5 MolecularWeight: 281.64862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC2=C(C1=O)C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

COC(=O)C1=C(NC2=C(C1=O)C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C12H8ClNO5/c1-19-12(18)8-9(11(16)17)14-7-4-5(13)2-3-6(7)10(8)15/h2-4H,1H3,(H,14,15)(H,16,17)