methyl 3-[4-[4-(4-chloranylphenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl 3-[4-[4-(4-chloranylphenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl 3-[4-[4-(4-chlorophenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: 3-[4-[4-(4-chlorophenoxy)-1-oxobutoxy]-3-methoxyphenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl 3-[4-[4-(4-chlorophenoxy)butanoyloxy]-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: 3-[4-[4-(4-chlorophenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-acrylic acid methyl ester Formula: C22H20ClNO6 MolecularWeight: 429.8503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)OC)OC(=O)CCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)OC)OC(=O)CCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H20ClNO6/c1-27-20-13-15(12-16(14-24)22(26)28-2)5-10-19(20)30-21(25)4-3-11-29-18-8-6-17(23)7-9-18/h5-10,12-13H,3-4,11H2,1-2H3