[1-(heptylsulfonylamino)-1-pyridin-3-yl-propan-2-yl] dihydrogen phosphate

Systemtic Name: [1-(heptylsulfonylamino)-1-pyridin-3-yl-propan-2-yl] dihydrogen phosphate Openeye Name: [2-(heptylsulfonylamino)-1-methyl-2-(3-pyridyl)ethyl] dihydrogen phosphate CAS Name: [1-(heptylsulfonylamino)-1-(3-pyridinyl)propan-2-yl] dihydrogen phosphate IUPAC Name: [1-(heptylsulfonylamino)-1-pyridin-3-ylpropan-2-yl] dihydrogen phosphate Traditional Name: [2-(heptylsulfonylamino)-1-methyl-2-(3-pyridyl)ethyl] dihydrogen phosphate Formula: C15H27N2O6PS MolecularWeight: 394.423441

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCS(=O)(=O)NC(C1=CN=CC=C1)C(C)OP(=O)(O)O

Isomeric SMILES

CCCCCCCS(=O)(=O)NC(C1=CN=CC=C1)C(C)OP(=O)(O)O

InChI

InChI=1S/C15H27N2O6PS/c1-3-4-5-6-7-11-25(21,22)17-15(13(2)23-24(18,19)20)14-9-8-10-16-12-14/h8-10,12-13,15,17H,3-7,11H2,1-2H3,(H2,18,19,20)