[2-oxidanylidene-2-(2-oxidanylideneimidazolidin-1-yl)ethyl] 5-nitro-2-[(phenylmethyl)amino]benzoate

Systemtic Name: [2-oxidanylidene-2-(2-oxidanylideneimidazolidin-1-yl)ethyl] 5-nitro-2-[(phenylmethyl)amino]benzoate Openeye Name: [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(benzylamino)-5-nitro-benzoate CAS Name: 5-nitro-2-[(phenylmethyl)amino]benzoic acid [2-oxo-2-(2-oxo-1-imidazolidinyl)ethyl] ester IUPAC Name: [2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(benzylamino)-5-nitrobenzoate Traditional Name: 2-(benzylamino)-5-nitro-benzoic acid [2-keto-2-(2-ketoimidazolidin-1-yl)ethyl] ester Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)N1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C19H18N4O6/c24-17(22-9-8-20-19(22)26)12-29-18(25)15-10-14(23(27)28)6-7-16(15)21-11-13-4-2-1-3-5-13/h1-7,10,21H,8-9,11-12H2,(H,20,26)