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

Systemtic Name: [1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 3-cyanobenzoate Openeye Name: [1-methyl-2-oxo-2-(phenylcarbamoylamino)ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-[[anilino(oxo)methyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-oxo-1-(phenylcarbamoylamino)propan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-keto-1-methyl-2-(phenylcarbamoylamino)ethyl] ester Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=CC=C1)OC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C18H15N3O4/c1-12(25-17(23)14-7-5-6-13(10-14)11-19)16(22)21-18(24)20-15-8-3-2-4-9-15/h2-10,12H,1H3,(H2,20,21,22,24)