cyanomethyl (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: cyanomethyl (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: cyanomethyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid cyanomethyl ester IUPAC Name: cyanomethyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid cyanomethyl ester Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC#N)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC#N)O

InChI

InChI=1S/C12H11NO4/c1-16-11-8-9(2-4-10(11)14)3-5-12(15)17-7-6-13/h2-5,8,14H,7H2,1H3/b5-3+