[2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl] 2-chloranyl-4-nitro-benzoate Openeye Name: (2-oxo-2-ureido-ethyl) 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [2-(carbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(carbamoylamino)-2-oxoethyl] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (2-keto-2-ureido-ethyl) ester Formula: C10H8ClN3O6 MolecularWeight: 301.64002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8ClN3O6/c11-7-3-5(14(18)19)1-2-6(7)9(16)20-4-8(15)13-10(12)17/h1-3H,4H2,(H3,12,13,15,17)