5-[(2-azanyl-2-oxidanylidene-ethyl)amino]-2-nitro-benzoate

Systemtic Name: 5-[(2-azanyl-2-oxidanylidene-ethyl)amino]-2-nitro-benzoate Openeye Name: 5-[(2-amino-2-oxo-ethyl)amino]-2-nitro-benzoate CAS Name: 5-[(2-amino-2-oxoethyl)amino]-2-nitrobenzoate IUPAC Name: 5-[(2-amino-2-oxoethyl)amino]-2-nitrobenzoate Traditional Name: 5-[(2-amino-2-keto-ethyl)amino]-2-nitro-benzoate Formula: C9H8N3O5- MolecularWeight: 238.17692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCC(=O)N)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1NCC(=O)N)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H9N3O5/c10-8(13)4-11-5-1-2-7(12(16)17)6(3-5)9(14)15/h1-3,11H,4H2,(H2,10,13)(H,14,15)/p-1