7-chloranyl-4-(2-phosphonoethyl)quinoline-2-carboxylic acid

Systemtic Name: 7-chloranyl-4-(2-phosphonoethyl)quinoline-2-carboxylic acid Openeye Name: 7-chloro-4-(2-phosphonoethyl)quinoline-2-carboxylic acid CAS Name: 7-chloro-4-(2-phosphonoethyl)-2-quinolinecarboxylic acid IUPAC Name: 7-chloro-4-(2-phosphonoethyl)quinoline-2-carboxylic acid Traditional Name: 7-chloro-4-(2-phosphonoethyl)quinaldic acid Formula: C12H11ClNO5P MolecularWeight: 315.646201

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(C=C2CCP(=O)(O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(C=C2CCP(=O)(O)O)C(=O)O

InChI

InChI=1S/C12H11ClNO5P/c13-8-1-2-9-7(3-4-20(17,18)19)5-11(12(15)16)14-10(9)6-8/h1-2,5-6H,3-4H2,(H,15,16)(H2,17,18,19)