7-[methylsulfonyl-[(E)-5-oxidanyl-5-(1-propylcyclobutyl)pent-2-enyl]amino]heptanoic acid

Systemtic Name: 7-[methylsulfonyl-[(E)-5-oxidanyl-5-(1-propylcyclobutyl)pent-2-enyl]amino]heptanoic acid Openeye Name: 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-methylsulfonyl-amino]heptanoic acid CAS Name: 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-methylsulfonylamino]heptanoic acid IUPAC Name: 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-methylsulfonylamino]heptanoic acid Traditional Name: 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-mesyl-amino]enanthic acid Formula: C20H37NO5S MolecularWeight: 403.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC1)C(CC=CCN(CCCCCCC(=O)O)S(=O)(=O)C)O

Isomeric SMILES

CCCC1(CCC1)C(C/C=C/CN(CCCCCCC(=O)O)S(=O)(=O)C)O

InChI

InChI=1S/C20H37NO5S/c1-3-13-20(14-10-15-20)18(22)11-7-9-17-21(27(2,25)26)16-8-5-4-6-12-19(23)24/h7,9,18,22H,3-6,8,10-17H2,1-2H3,(H,23,24)/b9-7+