[2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-propan-2-ylphenoxy)ethanoate

Systemtic Name: [2-[cyanomethyl(phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-propan-2-ylphenoxy)ethanoate Openeye Name: [2-[N-(cyanomethyl)anilino]-2-oxo-ethyl] 2-(4-isopropylphenoxy)acetate CAS Name: 2-(4-propan-2-ylphenoxy)acetic acid [2-[N-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(cyanomethyl)anilino]-2-oxoethyl] 2-(4-propan-2-ylphenoxy)acetate Traditional Name: 2-(4-isopropylphenoxy)acetic acid [2-[N-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4/c1-16(2)17-8-10-19(11-9-17)26-15-21(25)27-14-20(24)23(13-12-22)18-6-4-3-5-7-18/h3-11,16H,13-15H2,1-2H3