[4-[(5-azanylpentan-2-ylamino)methyl]-6-methyl-5-oxidanyl-pyridin-3-yl]methyl dihydrogen phosphate

Systemtic Name: [4-[(5-azanylpentan-2-ylamino)methyl]-6-methyl-5-oxidanyl-pyridin-3-yl]methyl dihydrogen phosphate Openeye Name: [4-[[(4-amino-1-methyl-butyl)amino]methyl]-5-hydroxy-6-methyl-3-pyridyl]methyl dihydrogen phosphate CAS Name: [4-[(5-aminopentan-2-ylamino)methyl]-5-hydroxy-6-methyl-3-pyridinyl]methyl dihydrogen phosphate IUPAC Name: [4-[(5-aminopentan-2-ylamino)methyl]-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate Traditional Name: [4-[[(4-amino-1-methyl-butyl)amino]methyl]-5-hydroxy-6-methyl-3-pyridyl]methyl dihydrogen phosphate Formula: C13H24N3O5P MolecularWeight: 333.320521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CNC(C)CCCN)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=C1O)CNC(C)CCCN)COP(=O)(O)O

InChI

InChI=1S/C13H24N3O5P/c1-9(4-3-5-14)15-7-12-11(8-21-22(18,19)20)6-16-10(2)13(12)17/h6,9,15,17H,3-5,7-8,14H2,1-2H3,(H2,18,19,20)