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

Systemtic Name: 4-[[(E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxyphenyl]-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acryloyl]amino]benzoate Formula: C20H14N3O5- MolecularWeight: 376.34226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)[O-])OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)[O-])OCC#N

InChI

InChI=1S/C20H15N3O5/c1-27-18-11-13(2-7-17(18)28-9-8-21)10-15(12-22)19(24)23-16-5-3-14(4-6-16)20(25)26/h2-7,10-11H,9H2,1H3,(H,23,24)(H,25,26)/p-1/b15-10+