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

Systemtic Name: methyl 3-[2-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]oxyethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[(E)-2-cyano-3-(p-tolyl)prop-2-enoyl]oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(E)-2-cyano-3-(4-methylphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(E)-2-cyano-3-(p-tolyl)acryloyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C22H20N2O5/c1-14-4-7-16(8-5-14)10-18(12-23)22(27)29-13-20(25)24-19-11-17(21(26)28-3)9-6-15(19)2/h4-11H,13H2,1-3H3,(H,24,25)/b18-10+