7-[methylsulfonyl-(4-oxidanyl-4-propyl-hept-2-ynyl)amino]heptanoic acid

Systemtic Name: 7-[methylsulfonyl-(4-oxidanyl-4-propyl-hept-2-ynyl)amino]heptanoic acid Openeye Name: 7-[(4-hydroxy-4-propyl-hept-2-ynyl)-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[(4-hydroxy-4-propylhept-2-ynyl)-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[(4-hydroxy-4-propylhept-2-ynyl)-methylsulfonylamino]heptanoic acid Traditional Name: 7-[(4-hydroxy-4-propyl-hept-2-ynyl)-mesyl-amino]enanthic acid Formula: C18H33NO5S MolecularWeight: 375.52332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C#CCN(CCCCCCC(=O)O)S(=O)(=O)C)O

Isomeric SMILES

CCCC(CCC)(C#CCN(CCCCCCC(=O)O)S(=O)(=O)C)O

InChI

InChI=1S/C18H33NO5S/c1-4-12-18(22,13-5-2)14-10-16-19(25(3,23)24)15-9-7-6-8-11-17(20)21/h22H,4-9,11-13,15-16H2,1-3H3,(H,20,21)