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

Systemtic Name: ethyl 3-[4-[4-(4-chloranylphenoxy)butanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C23H22ClNO6 MolecularWeight: 443.87688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)CCCOC2=CC=C(C=C2)Cl)OC)C#N

Isomeric SMILES

CCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)CCCOC2=CC=C(C=C2)Cl)OC)C#N

InChI

InChI=1S/C23H22ClNO6/c1-3-29-23(27)17(15-25)13-16-6-11-20(21(14-16)28-2)31-22(26)5-4-12-30-19-9-7-18(24)8-10-19/h6-11,13-14H,3-5,12H2,1-2H3