8-[[[2,6-bis(chloranyl)phenyl]carbonylamino]-oxidanyl-methyl]quinoline-3-carboxylic acid

Systemtic Name: 8-[[[2,6-bis(chloranyl)phenyl]carbonylamino]-oxidanyl-methyl]quinoline-3-carboxylic acid Openeye Name: 8-[[(2,6-dichlorobenzoyl)amino]-hydroxy-methyl]quinoline-3-carboxylic acid CAS Name: 8-[[[(2,6-dichlorophenyl)-oxomethyl]amino]-hydroxymethyl]-3-quinolinecarboxylic acid IUPAC Name: 8-[[(2,6-dichlorobenzoyl)amino]-hydroxymethyl]quinoline-3-carboxylic acid Traditional Name: 8-[[(2,6-dichlorobenzoyl)amino]-hydroxy-methyl]quinoline-3-carboxylic acid Formula: C18H12Cl2N2O4 MolecularWeight: 391.20488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CN=C2C(=C1)C(NC(=O)C3=C(C=CC=C3Cl)Cl)O)C(=O)O

Isomeric SMILES

C1=CC2=CC(=CN=C2C(=C1)C(NC(=O)C3=C(C=CC=C3Cl)Cl)O)C(=O)O

InChI

InChI=1S/C18H12Cl2N2O4/c19-12-5-2-6-13(20)14(12)17(24)22-16(23)11-4-1-3-9-7-10(18(25)26)8-21-15(9)11/h1-8,16,23H,(H,22,24)(H,25,26)