[[(2-carboxy-4-methyl-pentyl)-oxidanyl-phosphoryl]-phenyl-methyl]azanium chloride

Systemtic Name: [[(2-carboxy-4-methyl-pentyl)-oxidanyl-phosphoryl]-phenyl-methyl]azanium chloride Openeye Name: [[(2-carboxy-4-methyl-pentyl)-hydroxy-phosphoryl]-phenyl-methyl]ammonium chloride CAS Name: [[(2-carboxy-4-methylpentyl)-hydroxyphosphoryl]-phenylmethyl]ammonium chloride IUPAC Name: [[(2-carboxy-4-methylpentyl)-hydroxyphosphoryl]-phenylmethyl]azanium chloride Traditional Name: [[(2-carboxy-4-methyl-pentyl)-hydroxy-phosphoryl]-phenyl-methyl]ammonium chloride Formula: C14H23ClNO4P MolecularWeight: 335.763481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CP(=O)(C(C1=CC=CC=C1)[NH3+])O)C(=O)O.[Cl-]

Isomeric SMILES

CC(C)CC(CP(=O)(C(C1=CC=CC=C1)[NH3+])O)C(=O)O.[Cl-]

InChI

InChI=1S/C14H22NO4P.ClH/c1-10(2)8-12(14(16)17)9-20(18,19)13(15)11-6-4-3-5-7-11;/h3-7,10,12-13H,8-9,15H2,1-2H3,(H,16,17)(H,18,19);1H