methyl (E)-3-[4-[3-(4-butoxy-3-ethoxy-phenyl)propanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[4-[3-(4-butoxy-3-ethoxy-phenyl)propanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[4-[3-(4-butoxy-3-ethoxy-phenyl)propanoyloxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[3-(4-butoxy-3-ethoxyphenyl)-1-oxopropoxy]-3-methoxyphenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[3-(4-butoxy-3-ethoxyphenyl)propanoyloxy]-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[3-(4-butoxy-3-ethoxy-phenyl)propanoyloxy]-3-methoxy-phenyl]-2-cyano-acrylic acid methyl ester Formula: C27H31NO7 MolecularWeight: 481.53754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)OC)OC)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)OC)OC)OCC

InChI

InChI=1S/C27H31NO7/c1-5-7-14-34-22-11-8-19(16-25(22)33-6-2)10-13-26(29)35-23-12-9-20(17-24(23)31-3)15-21(18-28)27(30)32-4/h8-9,11-12,15-17H,5-7,10,13-14H2,1-4H3/b21-15+