4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]-1-cyano-vinyl]benzoic acid CAS Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]-1-cyanoethenyl]benzoic acid Traditional Name: 4-[2-[4-(4-chlorobenzyl)oxy-3-ethoxy-phenyl]-1-cyano-vinyl]benzoic acid Formula: C25H20ClNO4 MolecularWeight: 433.8836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C2=CC=C(C=C2)C(=O)O)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H20ClNO4/c1-2-30-24-14-18(5-12-23(24)31-16-17-3-10-22(26)11-4-17)13-21(15-27)19-6-8-20(9-7-19)25(28)29/h3-14H,2,16H2,1H3,(H,28,29)