ethyl 7-[methylsulfonyl-(4-oxidanyl-5-pyridin-3-yloxy-pentyl)amino]heptanoate

Systemtic Name: ethyl 7-[methylsulfonyl-(4-oxidanyl-5-pyridin-3-yloxy-pentyl)amino]heptanoate Openeye Name: ethyl 7-[[4-hydroxy-5-(3-pyridyloxy)pentyl]-methylsulfonyl-amino]heptanoate CAS Name: 7-[[4-hydroxy-5-(3-pyridinyloxy)pentyl]-methylsulfonylamino]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[(4-hydroxy-5-pyridin-3-yloxypentyl)-methylsulfonylamino]heptanoate Traditional Name: 7-[[4-hydroxy-5-(3-pyridyloxy)pentyl]-mesyl-amino]enanthic acid ethyl ester Formula: C20H34N2O6S MolecularWeight: 430.55876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN(CCCC(COC1=CN=CC=C1)O)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCCCCCN(CCCC(COC1=CN=CC=C1)O)S(=O)(=O)C

InChI

InChI=1S/C20H34N2O6S/c1-3-27-20(24)12-6-4-5-7-14-22(29(2,25)26)15-9-10-18(23)17-28-19-11-8-13-21-16-19/h8,11,13,16,18,23H,3-7,9-10,12,14-15,17H2,1-2H3