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

Systemtic Name: ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate Openeye Name: ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acryloyl]amino]benzoic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C=CC2=CC(=C(C=C2)OCC#N)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)/C=C/C2=CC(=C(C=C2)OCC#N)OC

InChI

InChI=1S/C21H20N2O5/c1-3-27-21(25)16-6-4-5-7-17(16)23-20(24)11-9-15-8-10-18(28-13-12-22)19(14-15)26-2/h4-11,14H,3,13H2,1-2H3,(H,23,24)/b11-9+