[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate

Systemtic Name: [1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 4-cyanobenzoate Openeye Name: (1-methyl-2-oxo-2-ureido-ethyl) 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-1-oxopropan-2-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (2-keto-1-methyl-2-ureido-ethyl) ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O4/c1-7(10(16)15-12(14)18)19-11(17)9-4-2-8(6-13)3-5-9/h2-5,7H,1H3,(H3,14,15,16,18)