methyl 3-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 3-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate Openeye Name: methyl 3-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate CAS Name: 3-[[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoyl]amino]benzoate Traditional Name: 3-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acryloyl]amino]benzoic acid methyl ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)NC2=CC=CC(=C2)C(=O)OC)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)NC2=CC=CC(=C2)C(=O)OC)OCC#N

InChI

InChI=1S/C20H18N2O5/c1-25-18-12-14(6-8-17(18)27-11-10-21)7-9-19(23)22-16-5-3-4-15(13-16)20(24)26-2/h3-9,12-13H,11H2,1-2H3,(H,22,23)/b9-7+