[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-ethanoyl-2-methoxy-phenoxy)ethanoate

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-ethanoyl-2-methoxy-phenoxy)ethanoate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] 2-(4-acetyl-2-methoxy-phenoxy)acetate CAS Name: 2-(4-acetyl-2-methoxyphenoxy)acetic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] 2-(4-acetyl-2-methoxyphenoxy)acetate Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)acetic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O6/c1-15(24)16-8-9-18(19(12-16)27-2)28-14-21(26)29-13-20(25)23(11-10-22)17-6-4-3-5-7-17/h3-9,12H,11,13-14H2,1-2H3