[8-(oxan-2-yloxy)-1-pyridin-3-yl-octan-4-yl] methanesulfonate

Systemtic Name: [8-(oxan-2-yloxy)-1-pyridin-3-yl-octan-4-yl] methanesulfonate Openeye Name: [1-[3-(3-pyridyl)propyl]-5-tetrahydropyran-2-yloxy-pentyl] methanesulfonate CAS Name: methanesulfonic acid [8-(2-oxanyloxy)-1-(3-pyridinyl)octan-4-yl] ester IUPAC Name: [8-(oxan-2-yloxy)-1-pyridin-3-yloctan-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[3-(3-pyridyl)propyl]-5-tetrahydropyran-2-yloxy-pentyl] ester Formula: C19H31NO5S MolecularWeight: 385.51814

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CCCCOC1CCCCO1)CCCC2=CN=CC=C2

Isomeric SMILES

CS(=O)(=O)OC(CCCCOC1CCCCO1)CCCC2=CN=CC=C2

InChI

InChI=1S/C19H31NO5S/c1-26(21,22)25-18(11-6-8-17-9-7-13-20-16-17)10-2-4-14-23-19-12-3-5-15-24-19/h7,9,13,16,18-19H,2-6,8,10-12,14-15H2,1H3