prop-2-enyl (E)-3-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: prop-2-enyl (E)-3-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: allyl (E)-3-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-2-cyano-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-3-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-(4-chlorobenzyl)oxy-3-methoxy-phenyl]-2-cyano-acrylic acid allyl ester Formula: C21H18ClNO4 MolecularWeight: 383.82492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)OCC=C)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)OCC=C)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H18ClNO4/c1-3-10-26-21(24)17(13-23)11-16-6-9-19(20(12-16)25-2)27-14-15-4-7-18(22)8-5-15/h3-9,11-12H,1,10,14H2,2H3/b17-11+