2-[4-[(4-nitrophenyl)methoxy-oxidanyl-phosphoryl]butanoylamino]ethanoic acid

Systemtic Name: 2-[4-[(4-nitrophenyl)methoxy-oxidanyl-phosphoryl]butanoylamino]ethanoic acid Openeye Name: 2-[4-[hydroxy-[(4-nitrophenyl)methoxy]phosphoryl]butanoylamino]acetic acid CAS Name: 2-[[4-[hydroxy-[(4-nitrophenyl)methoxy]phosphoryl]-1-oxobutyl]amino]acetic acid IUPAC Name: 2-[4-[hydroxy-[(4-nitrophenyl)methoxy]phosphoryl]butanoylamino]acetic acid Traditional Name: 2-[4-[hydroxy-(4-nitrobenzyl)oxy-phosphoryl]butanoylamino]acetic acid Formula: C13H17N2O8P MolecularWeight: 360.256441

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COP(=O)(CCCC(=O)NCC(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COP(=O)(CCCC(=O)NCC(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H17N2O8P/c16-12(14-8-13(17)18)2-1-7-24(21,22)23-9-10-3-5-11(6-4-10)15(19)20/h3-6H,1-2,7-9H2,(H,14,16)(H,17,18)(H,21,22)