[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC=CC(=C1)C#N

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H16N2O3/c1-3-10(2)16-13(17)9-19-14(18)12-6-4-5-11(7-12)8-15/h4-7,10H,3,9H2,1-2H3,(H,16,17)