4-[2-[[oxidanyl(phenethyl)phosphoryl]amino]propanoylamino]benzoic acid

Systemtic Name: 4-[2-[[oxidanyl(phenethyl)phosphoryl]amino]propanoylamino]benzoic acid Openeye Name: 4-[2-[[hydroxy(phenethyl)phosphoryl]amino]propanoylamino]benzoic acid CAS Name: 4-[[2-[[hydroxy(phenethyl)phosphoryl]amino]-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[2-[[hydroxy(phenethyl)phosphoryl]amino]propanoylamino]benzoic acid Traditional Name: 4-[2-[[hydroxy(phenethyl)phosphoryl]amino]propanoylamino]benzoic acid Formula: C18H21N2O5P MolecularWeight: 376.343501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)O)NP(=O)(CCC2=CC=CC=C2)O

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)O)NP(=O)(CCC2=CC=CC=C2)O

InChI

InChI=1S/C18H21N2O5P/c1-13(17(21)19-16-9-7-15(8-10-16)18(22)23)20-26(24,25)12-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,19,21)(H,22,23)(H2,20,24,25)