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

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C16H17N3O6 MolecularWeight: 347.32268

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)C=CC1=CC(=C(C=C1)OCC#N)OC

Isomeric SMILES

CNC(=O)NC(=O)COC(=O)/C=C/C1=CC(=C(C=C1)OCC#N)OC

InChI

InChI=1S/C16H17N3O6/c1-18-16(22)19-14(20)10-25-15(21)6-4-11-3-5-12(24-8-7-17)13(9-11)23-2/h3-6,9H,8,10H2,1-2H3,(H2,18,19,20,22)/b6-4+