1-[[2,3-bis(chloranyl)phenyl]methyl]-4-oxidanylidene-7-pyridin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]methyl]-4-oxidanylidene-7-pyridin-4-yl-quinoline-3-carboxylic acid Openeye Name: 1-[(2,3-dichlorophenyl)methyl]-4-oxo-7-(4-pyridyl)quinoline-3-carboxylic acid CAS Name: 1-[(2,3-dichlorophenyl)methyl]-4-oxo-7-pyridin-4-yl-3-quinolinecarboxylic acid IUPAC Name: 1-[(2,3-dichlorophenyl)methyl]-4-oxo-7-pyridin-4-ylquinoline-3-carboxylic acid Traditional Name: 1-(2,3-dichlorobenzyl)-4-keto-7-(4-pyridyl)quinoline-3-carboxylic acid Formula: C22H14Cl2N2O3 MolecularWeight: 425.26416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)Cl)CN2C=C(C(=O)C3=C2C=C(C=C3)C4=CC=NC=C4)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)Cl)CN2C=C(C(=O)C3=C2C=C(C=C3)C4=CC=NC=C4)C(=O)O

InChI

InChI=1S/C22H14Cl2N2O3/c23-18-3-1-2-15(20(18)24)11-26-12-17(22(28)29)21(27)16-5-4-14(10-19(16)26)13-6-8-25-9-7-13/h1-10,12H,11H2,(H,28,29)