2-methoxyethyl 4-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: 2-methoxyethyl 4-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]benzoate Openeye Name: 2-methoxyethyl 4-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[[(E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-p-phenetyl-acryloyl]amino]benzoic acid 2-methoxyethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)OCCOC

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)OCCOC

InChI

InChI=1S/C22H22N2O5/c1-3-28-20-10-4-16(5-11-20)14-18(15-23)21(25)24-19-8-6-17(7-9-19)22(26)29-13-12-27-2/h4-11,14H,3,12-13H2,1-2H3,(H,24,25)/b18-14+