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

Systemtic Name: 2-[[(E)-2-cyano-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoyl]amino]benzoate Openeye Name: 2-[[(E)-2-cyano-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-2-cyano-3-(3-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 2-[[(E)-2-cyano-3-(3-ethoxy-4-methoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-2-cyano-3-(3-ethoxy-4-methoxy-phenyl)acryloyl]amino]benzoate Formula: C20H17N2O5- MolecularWeight: 365.35938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC=C2C(=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=CC=C2C(=O)[O-])OC

InChI

InChI=1S/C20H18N2O5/c1-3-27-18-11-13(8-9-17(18)26-2)10-14(12-21)19(23)22-16-7-5-4-6-15(16)20(24)25/h4-11H,3H2,1-2H3,(H,22,23)(H,24,25)/p-1/b14-10+