3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoic acid Openeye Name: 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoic acid CAS Name: 3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid IUPAC Name: 3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoic acid Traditional Name: 3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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