[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 4-cyanobenzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4/c1-9(2)16-14(20)17-12(18)8-21-13(19)11-5-3-10(7-15)4-6-11/h3-6,9H,8H2,1-2H3,(H2,16,17,18,20)