[1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 2-nitrobenzoate

Systemtic Name: [1-oxidanylidene-1-(propan-2-ylcarbamoylamino)propan-2-yl] 2-nitrobenzoate Openeye Name: [2-(isopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [1-oxo-1-[[oxo-(propan-2-ylamino)methyl]amino]propan-2-yl] ester IUPAC Name: [1-oxo-1-(propan-2-ylcarbamoylamino)propan-2-yl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-(isopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H17N3O6 MolecularWeight: 323.30128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)OC(=O)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)NC(=O)C(C)OC(=O)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c1-8(2)15-14(20)16-12(18)9(3)23-13(19)10-6-4-5-7-11(10)17(21)22/h4-9H,1-3H3,(H2,15,16,18,20)