ethyl (E)-3-[3-[(E)-3-(2-butoxyphenyl)prop-2-enoyl]oxyphenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[(E)-3-(2-butoxyphenyl)prop-2-enoyl]oxyphenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[(E)-3-(2-butoxyphenyl)prop-2-enoyl]oxyphenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[(E)-3-(2-butoxyphenyl)-1-oxoprop-2-enoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[(E)-3-(2-butoxyphenyl)prop-2-enoyl]oxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[(E)-3-(2-butoxyphenyl)acryloyl]oxyphenyl]-2-cyano-acrylic acid ethyl ester Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C=CC(=O)OC2=CC=CC(=C2)C=C(C#N)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO5/c1-3-5-15-30-23-12-7-6-10-20(23)13-14-24(27)31-22-11-8-9-19(17-22)16-21(18-26)25(28)29-4-2/h6-14,16-17H,3-5,15H2,1-2H3/b14-13+,21-16+