methyl 4-[2-[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(E)-2-cyano-3-(4-methoxyphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(E)-2-cyano-3-(4-methoxyphenyl)acryloyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O6/c1-27-18-9-3-14(4-10-18)11-16(12-22)21(26)29-13-19(24)23-17-7-5-15(6-8-17)20(25)28-2/h3-11H,13H2,1-2H3,(H,23,24)/b16-11+