[[(3-nitrophenyl)amino]-phosphono-methyl]phosphonic acid

Systemtic Name: [[(3-nitrophenyl)amino]-phosphono-methyl]phosphonic acid Openeye Name: [(3-nitroanilino)-phosphono-methyl]phosphonic acid CAS Name: [(3-nitroanilino)-phosphonomethyl]phosphonic acid IUPAC Name: [(3-nitroanilino)-phosphonomethyl]phosphonic acid Traditional Name: [(3-nitroanilino)-phosphono-methyl]phosphonic acid Formula: C7H10N2O8P2 MolecularWeight: 312.110422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C7H10N2O8P2/c10-9(11)6-3-1-2-5(4-6)8-7(18(12,13)14)19(15,16)17/h1-4,7-8H,(H2,12,13,14)(H2,15,16,17)