ethyl (E)-3-[3-[2-(2-tert-butyl-4-methyl-phenoxy)ethanoyloxy]phenyl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[2-(2-tert-butyl-4-methyl-phenoxy)ethanoyloxy]phenyl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[3-[2-(2-tert-butyl-4-methyl-phenoxy)acetyl]oxyphenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[2-(2-tert-butyl-4-methylphenoxy)-1-oxoethoxy]phenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[2-(2-tert-butyl-4-methylphenoxy)acetyl]oxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-[2-(2-tert-butyl-4-methyl-phenoxy)acetyl]oxyphenyl]-2-cyano-acrylic acid ethyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=CC=C1)OC(=O)COC2=C(C=C(C=C2)C)C(C)(C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=CC=C1)OC(=O)COC2=C(C=C(C=C2)C)C(C)(C)C)/C#N

InChI

InChI=1S/C25H27NO5/c1-6-29-24(28)19(15-26)13-18-8-7-9-20(14-18)31-23(27)16-30-22-11-10-17(2)12-21(22)25(3,4)5/h7-14H,6,16H2,1-5H3/b19-13+