6-[[2,3-bis(chloranyl)phenyl]methyl]-1-(dimethylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-[[2,3-bis(chloranyl)phenyl]methyl]-1-(dimethylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-[(2,3-dichlorophenyl)methyl]-1-(dimethylamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-[(2,3-dichlorophenyl)methyl]-1-(dimethylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-[(2,3-dichlorophenyl)methyl]-1-(dimethylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-(2,3-dichlorobenzyl)-1-(dimethylamino)-4-keto-quinoline-3-carboxylic acid Formula: C19H16Cl2N2O3 MolecularWeight: 391.24794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)N1C=C(C(=O)C2=C1C=CC(=C2)CC3=C(C(=CC=C3)Cl)Cl)C(=O)O

Isomeric SMILES

CN(C)N1C=C(C(=O)C2=C1C=CC(=C2)CC3=C(C(=CC=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C19H16Cl2N2O3/c1-22(2)23-10-14(19(25)26)18(24)13-9-11(6-7-16(13)23)8-12-4-3-5-15(20)17(12)21/h3-7,9-10H,8H2,1-2H3,(H,25,26)