[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Openeye Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-ethoxyphenyl)-2-propenoic acid [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] (E)-2-cyano-3-(4-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-p-phenetyl-acrylic acid [2-keto-2-[[(1R)-1-phenylethyl]amino]ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C#N)C(=O)OCC(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC(=O)N[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C22H22N2O4/c1-3-27-20-11-9-17(10-12-20)13-19(14-23)22(26)28-15-21(25)24-16(2)18-7-5-4-6-8-18/h4-13,16H,3,15H2,1-2H3,(H,24,25)/b19-13+/t16-/m1/s1