[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-methyl-3-nitro-benzoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-methyl-3-nitro-benzoate Openeye Name: (2-oxo-2-ureido-ethyl) 2-methyl-3-nitro-benzoate CAS Name: 2-methyl-3-nitrobenzoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 2-methyl-3-nitrobenzoate Traditional Name: 2-methyl-3-nitro-benzoic acid (2-keto-2-ureido-ethyl) ester Formula: C11H11N3O6 MolecularWeight: 281.22154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)NC(=O)N

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)OCC(=O)NC(=O)N

InChI

InChI=1S/C11H11N3O6/c1-6-7(3-2-4-8(6)14(18)19)10(16)20-5-9(15)13-11(12)17/h2-4H,5H2,1H3,(H3,12,13,15,17)