2-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]-5-nitro-benzoic acid

Systemtic Name: 2-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]-5-nitro-benzoic acid Openeye Name: 2-[(2-amino-2-oxo-ethyl)-methyl-amino]-5-nitro-benzoic acid CAS Name: 2-[(2-amino-2-oxoethyl)-methylamino]-5-nitrobenzoic acid IUPAC Name: 2-[(2-amino-2-oxoethyl)-methylamino]-5-nitrobenzoic acid Traditional Name: 2-[(2-amino-2-keto-ethyl)-methyl-amino]-5-nitro-benzoic acid Formula: C10H11N3O5 MolecularWeight: 253.21144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O5/c1-12(5-9(11)14)8-3-2-6(13(17)18)4-7(8)10(15)16/h2-4H,5H2,1H3,(H2,11,14)(H,15,16)