6-[[4-(acetamidomethyl)-5-(hydroxymethyl)-2-methyl-pyridin-3-yl]oxy-oxidanyl-phosphoryl]hexanoic acid

Systemtic Name: 6-[[4-(acetamidomethyl)-5-(hydroxymethyl)-2-methyl-pyridin-3-yl]oxy-oxidanyl-phosphoryl]hexanoic acid Openeye Name: 6-[[4-(acetamidomethyl)-5-(hydroxymethyl)-2-methyl-3-pyridyl]oxy-hydroxy-phosphoryl]hexanoic acid CAS Name: 6-[[4-(acetamidomethyl)-5-(hydroxymethyl)-2-methyl-3-pyridinyl]oxy-hydroxyphosphoryl]hexanoic acid IUPAC Name: 6-[[4-(acetamidomethyl)-5-(hydroxymethyl)-2-methylpyridin-3-yl]oxy-hydroxyphosphoryl]hexanoic acid Traditional Name: 6-[[4-(acetamidomethyl)-2-methyl-5-methylol-3-pyridyl]oxy-hydroxy-phosphoryl]hexanoic acid Formula: C16H25N2O7P MolecularWeight: 388.352661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1OP(=O)(CCCCCC(=O)O)O)CNC(=O)C)CO

Isomeric SMILES

CC1=NC=C(C(=C1OP(=O)(CCCCCC(=O)O)O)CNC(=O)C)CO

InChI

InChI=1S/C16H25N2O7P/c1-11-16(14(9-18-12(2)20)13(10-19)8-17-11)25-26(23,24)7-5-3-4-6-15(21)22/h8,19H,3-7,9-10H2,1-2H3,(H,18,20)(H,21,22)(H,23,24)