ethyl (E)-2-cyano-3-[3-ethoxy-4-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoyloxy]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[3-ethoxy-4-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoyloxy]phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[3-ethoxy-4-[4-(4-isopropyl-3-methyl-phenoxy)butanoyloxy]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-ethoxy-4-[4-(3-methyl-4-propan-2-ylphenoxy)-1-oxobutoxy]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[3-ethoxy-4-[4-(3-methyl-4-propan-2-ylphenoxy)butanoyloxy]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-ethoxy-4-[4-(4-isopropyl-3-methyl-phenoxy)butanoyloxy]phenyl]acrylic acid ethyl ester Formula: C28H33NO6 MolecularWeight: 479.56472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)OCC)OC(=O)CCCOC2=CC(=C(C=C2)C(C)C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)OCC)OC(=O)CCCOC2=CC(=C(C=C2)C(C)C)C

InChI

InChI=1S/C28H33NO6/c1-6-32-26-17-21(16-22(18-29)28(31)33-7-2)10-13-25(26)35-27(30)9-8-14-34-23-11-12-24(19(3)4)20(5)15-23/h10-13,15-17,19H,6-9,14H2,1-5H3/b22-16+