butyl (E)-2-cyano-3-[3-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]prop-2-enoate

Systemtic Name: butyl (E)-2-cyano-3-[3-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]prop-2-enoate Openeye Name: butyl (E)-3-(4-tert-butoxycarbonyloxy-3-methoxy-phenyl)-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[3-methoxy-4-[(2-methylpropan-2-yl)oxy-oxomethoxy]phenyl]-2-propenoic acid butyl ester IUPAC Name: butyl (E)-2-cyano-3-[3-methoxy-4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]prop-2-enoate Traditional Name: (E)-3-(4-tert-butoxycarbonyloxy-3-methoxy-phenyl)-2-cyano-acrylic acid butyl ester Formula: C20H25NO6 MolecularWeight: 375.4156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC(=C(C=C1)OC(=O)OC(C)(C)C)OC)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC(=C(C=C1)OC(=O)OC(C)(C)C)OC)/C#N

InChI

InChI=1S/C20H25NO6/c1-6-7-10-25-18(22)15(13-21)11-14-8-9-16(17(12-14)24-5)26-19(23)27-20(2,3)4/h8-9,11-12H,6-7,10H2,1-5H3/b15-11+