(E)-2-cyano-3-[4-(3,4,5-trimethoxyphenyl)carbonyloxyphenyl]prop-2-enoate

Systemtic Name: (E)-2-cyano-3-[4-(3,4,5-trimethoxyphenyl)carbonyloxyphenyl]prop-2-enoate Openeye Name: (E)-2-cyano-3-[4-(3,4,5-trimethoxybenzoyl)oxyphenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[4-[oxo-(3,4,5-trimethoxyphenyl)methoxy]phenyl]-2-propenoate IUPAC Name: (E)-2-cyano-3-[4-(3,4,5-trimethoxybenzoyl)oxyphenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(3,4,5-trimethoxybenzoyl)oxyphenyl]acrylate Formula: C20H16NO7- MolecularWeight: 382.34354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=C(C=C2)/C=C(\C#N)/C(=O)[O-]

InChI

InChI=1S/C20H17NO7/c1-25-16-9-13(10-17(26-2)18(16)27-3)20(24)28-15-6-4-12(5-7-15)8-14(11-21)19(22)23/h4-10H,1-3H3,(H,22,23)/p-1/b14-8+