AC1LR8VL

2-chloro-5-[5-[(E)-3-(4-chloroanilino)-2-cyano-3-oxoprop-1-enyl]furan-2-yl]benzoic acid

Also Known As: 2-chloro-5-(5-{3-[(4-chlorophenyl)amino]-2-cyano-3-oxo-1-propen-1-yl}-2-furyl)benzoic acid|2-chloro-5-(5-{(1E)-3-[(4-chlorophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid|2-chloro-5-[5-[(E)-3-(4-chloroanilino)-2-cyano-3-oxoprop-1-enyl]furan-2-yl]benzoic acid|2-chloro-5-[5-[2-[(4-chlorophenyl)carbamoyl]-2-cyano-ethenyl]-2-furyl]benzoic Acid|(E)-2-chloro-5-(5-(3-((4-chlorophenyl)amino)-2-cyano-3-oxoprop-1-en-1-yl)furan-2-yl)benzoic acid

Molecular Formula	C21H12Cl2N2O4
Molecular Weight	426.01743 g/mol
LogP	5.49728
Topological Polar Surface Area	103.33 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	426.01743
Monoisotopic Mass	426.01743
Heavy Atoms	29
Complexity	1158.1693

Chemical Identifiers

CAS Number	6031-72-7
SMILES	C1=CC(=CC=C1NC(=O)/C(=C/C2=CC=C(O2)C3=CC(=C(C=C3)Cl)C(=O)O)/C#N)Cl