ethyl (E)-2-[(4-methylphenyl)carbamoyl]-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-[(4-methylphenyl)carbamoyl]-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]prop-2-enoate Openeye Name: ethyl (E)-3-[(2-hydroxy-2-phenyl-acetyl)amino]-2-(p-tolylcarbamoyl)prop-2-enoate CAS Name: (E)-3-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-2-[(4-methylanilino)-oxomethyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(2-hydroxy-2-phenylacetyl)amino]-2-[(4-methylphenyl)carbamoyl]prop-2-enoate Traditional Name: (E)-3-(mandeloylamino)-2-(p-tolylcarbamoyl)acrylic acid ethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC(=O)C(C1=CC=CC=C1)O)C(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)/C(=C/NC(=O)C(C1=CC=CC=C1)O)/C(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C21H22N2O5/c1-3-28-21(27)17(19(25)23-16-11-9-14(2)10-12-16)13-22-20(26)18(24)15-7-5-4-6-8-15/h4-13,18,24H,3H2,1-2H3,(H,22,26)(H,23,25)/b17-13+