6-[4-[(4-nitrophenoxy)-oxidanyl-phosphoryl]butanoylamino]hexanoic acid

Systemtic Name: 6-[4-[(4-nitrophenoxy)-oxidanyl-phosphoryl]butanoylamino]hexanoic acid Openeye Name: 6-[4-[hydroxy-(4-nitrophenoxy)phosphoryl]butanoylamino]hexanoic acid CAS Name: 6-[[4-[hydroxy-(4-nitrophenoxy)phosphoryl]-1-oxobutyl]amino]hexanoic acid IUPAC Name: 6-[4-[hydroxy-(4-nitrophenoxy)phosphoryl]butanoylamino]hexanoic acid Traditional Name: 6-[4-[hydroxy-(4-nitrophenoxy)phosphoryl]butanoylamino]hexanoic acid Formula: C16H23N2O8P MolecularWeight: 402.336181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(CCCC(=O)NCCCCCC(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(CCCC(=O)NCCCCCC(=O)O)O

InChI

InChI=1S/C16H23N2O8P/c19-15(17-11-3-1-2-6-16(20)21)5-4-12-27(24,25)26-14-9-7-13(8-10-14)18(22)23/h7-10H,1-6,11-12H2,(H,17,19)(H,20,21)(H,24,25)