4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enyl-phenyl]-1-cyano-ethenyl]benzoic acid

Systemtic Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enyl-phenyl]-1-cyano-ethenyl]benzoic acid Openeye Name: 4-[2-[3-allyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]-1-cyano-vinyl]benzoic acid CAS Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]-1-cyanoethenyl]benzoic acid IUPAC Name: 4-[2-[4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-prop-2-enylphenyl]-1-cyanoethenyl]benzoic acid Traditional Name: 4-[2-[3-allyl-4-(4-chlorobenzyl)oxy-5-ethoxy-phenyl]-1-cyano-vinyl]benzoic acid Formula: C28H24ClNO4 MolecularWeight: 473.94746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)Cl)CC=C)C=C(C#N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)Cl)CC=C)C=C(C#N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C28H24ClNO4/c1-3-5-23-14-20(15-24(17-30)21-8-10-22(11-9-21)28(31)32)16-26(33-4-2)27(23)34-18-19-6-12-25(29)13-7-19/h3,6-16H,1,4-5,18H2,2H3,(H,31,32)