[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl] (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: [(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl] (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: [(1S)-2-amino-2-oxo-1-phenyl-ethyl] (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid [(1S)-2-amino-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-amino-2-oxo-1-phenylethyl] (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid [(1S)-2-amino-2-keto-1-phenyl-ethyl] ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OC(C2=CC=CC=C2)C(=O)N)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)O[C@@H](C2=CC=CC=C2)C(=O)N)OCC#N

InChI

InChI=1S/C20H18N2O5/c1-25-17-13-14(7-9-16(17)26-12-11-21)8-10-18(23)27-19(20(22)24)15-5-3-2-4-6-15/h2-10,13,19H,12H2,1H3,(H2,22,24)/b10-8+/t19-/m0/s1