2-[(4-nitrophenyl)carbonyl-(phosphonomethyl)amino]ethanoic acid

Systemtic Name: 2-[(4-nitrophenyl)carbonyl-(phosphonomethyl)amino]ethanoic acid Openeye Name: 2-[(4-nitrobenzoyl)-(phosphonomethyl)amino]acetic acid CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]-(phosphonomethyl)amino]acetic acid IUPAC Name: 2-[(4-nitrobenzoyl)-(phosphonomethyl)amino]acetic acid Traditional Name: 2-[(4-nitrobenzoyl)-(phosphonomethyl)amino]acetic acid Formula: C10H11N2O8P MolecularWeight: 318.176701

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N(CC(=O)O)CP(=O)(O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N(CC(=O)O)CP(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H11N2O8P/c13-9(14)5-11(6-21(18,19)20)10(15)7-1-3-8(4-2-7)12(16)17/h1-4H,5-6H2,(H,13,14)(H2,18,19,20)