[1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate

Systemtic Name: [1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate Openeye Name: [2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylamino)-1-oxopropan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C(=O)NC1CC1)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H14N2O3/c1-9(13(17)16-12-5-6-12)19-14(18)11-4-2-3-10(7-11)8-15/h2-4,7,9,12H,5-6H2,1H3,(H,16,17)