2-[[oxidanyl-(phenylmethyl)phosphoryl]methyl]-4-pyridin-3-yl-butanoic acid

Systemtic Name: 2-[[oxidanyl-(phenylmethyl)phosphoryl]methyl]-4-pyridin-3-yl-butanoic acid Openeye Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]-4-(3-pyridyl)butanoic acid CAS Name: 2-[[hydroxy-(phenylmethyl)phosphoryl]methyl]-4-(3-pyridinyl)butanoic acid IUPAC Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]-4-pyridin-3-ylbutanoic acid Traditional Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]-4-(3-pyridyl)butyric acid Formula: C17H20NO4P MolecularWeight: 333.318761

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CP(=O)(CC(CCC2=CN=CC=C2)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CP(=O)(CC(CCC2=CN=CC=C2)C(=O)O)O

InChI

InChI=1S/C17H20NO4P/c19-17(20)16(9-8-14-7-4-10-18-11-14)13-23(21,22)12-15-5-2-1-3-6-15/h1-7,10-11,16H,8-9,12-13H2,(H,19,20)(H,21,22)