5-nitro-1,3-dihydrobenzimidazol-2-one hydrate

Systemtic Name: 5-nitro-1,3-dihydrobenzimidazol-2-one hydrate Openeye Name: 5-nitro-1,3-dihydrobenzimidazol-2-one hydrate CAS Name: 5-nitro-1,3-dihydrobenzimidazol-2-one hydrate IUPAC Name: 5-nitro-1,3-dihydrobenzimidazol-2-one hydrate Traditional Name: 5-nitro-1,3-dihydrobenzimidazol-2-one hydrate Formula: C7H7N3O4 MolecularWeight: 197.14818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)N2.O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)N2.O

InChI

InChI=1S/C7H5N3O3.H2O/c11-7-8-5-2-1-4(10(12)13)3-6(5)9-7;/h1-3H,(H2,8,9,11);1H2