2-[6-chloranyl-4-(4-chlorophenyl)-2-oxidanylidene-1-(pyridin-4-ylmethyl)quinolin-3-yl]pentanoic acid

Systemtic Name: 2-[6-chloranyl-4-(4-chlorophenyl)-2-oxidanylidene-1-(pyridin-4-ylmethyl)quinolin-3-yl]pentanoic acid Openeye Name: 2-[6-chloro-4-(4-chlorophenyl)-2-oxo-1-(4-pyridylmethyl)-3-quinolyl]pentanoic acid CAS Name: 2-[6-chloro-4-(4-chlorophenyl)-2-oxo-1-(pyridin-4-ylmethyl)-3-quinolinyl]pentanoic acid IUPAC Name: 2-[6-chloro-4-(4-chlorophenyl)-2-oxo-1-(pyridin-4-ylmethyl)quinolin-3-yl]pentanoic acid Traditional Name: 2-[6-chloro-4-(4-chlorophenyl)-2-keto-1-(4-pyridylmethyl)-3-quinolyl]valeric acid Formula: C26H22Cl2N2O3 MolecularWeight: 481.37048

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C2=C(C=CC(=C2)Cl)N(C1=O)CC3=CC=NC=C3)C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

CCCC(C1=C(C2=C(C=CC(=C2)Cl)N(C1=O)CC3=CC=NC=C3)C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C26H22Cl2N2O3/c1-2-3-20(26(32)33)24-23(17-4-6-18(27)7-5-17)21-14-19(28)8-9-22(21)30(25(24)31)15-16-10-12-29-13-11-16/h4-14,20H,2-3,15H2,1H3,(H,32,33)