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

Systemtic Name: methyl (E)-2-cyano-3-[3-methoxy-4-[4-(3-methyl-4-propan-2-yl-phenoxy)butanoyloxy]phenyl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[4-[4-(4-isopropyl-3-methyl-phenoxy)butanoyloxy]-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-methoxy-4-[4-(3-methyl-4-propan-2-ylphenoxy)-1-oxobutoxy]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[3-methoxy-4-[4-(3-methyl-4-propan-2-ylphenoxy)butanoyloxy]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-[4-(4-isopropyl-3-methyl-phenoxy)butanoyloxy]-3-methoxy-phenyl]acrylic acid methyl ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)OC)OC)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)OC)OC)C(C)C

InChI

InChI=1S/C26H29NO6/c1-17(2)22-10-9-21(13-18(22)3)32-12-6-7-25(28)33-23-11-8-19(15-24(23)30-4)14-20(16-27)26(29)31-5/h8-11,13-15,17H,6-7,12H2,1-5H3/b20-14+