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

Systemtic Name: 2-[[oxidanyl-(phenylmethyl)phosphoryl]methyl]-4-pyridin-3-yl-pentanoic acid Openeye Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]-4-(3-pyridyl)pentanoic acid CAS Name: 2-[[hydroxy-(phenylmethyl)phosphoryl]methyl]-4-(3-pyridinyl)pentanoic acid IUPAC Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]-4-pyridin-3-ylpentanoic acid Traditional Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]-4-(3-pyridyl)valeric acid Formula: C18H22NO4P MolecularWeight: 347.345341

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CP(=O)(CC1=CC=CC=C1)O)C(=O)O)C2=CN=CC=C2

Isomeric SMILES

CC(CC(CP(=O)(CC1=CC=CC=C1)O)C(=O)O)C2=CN=CC=C2

InChI

InChI=1S/C18H22NO4P/c1-14(16-8-5-9-19-11-16)10-17(18(20)21)13-24(22,23)12-15-6-3-2-4-7-15/h2-9,11,14,17H,10,12-13H2,1H3,(H,20,21)(H,22,23)