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

Systemtic Name: ethyl 7-[methylsulfonyl-[(E)-5-oxidanyl-5-(1-propylcyclobutyl)pent-2-enyl]amino]heptanoate Openeye Name: ethyl 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-methylsulfonyl-amino]heptanoate CAS Name: 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-methylsulfonylamino]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-methylsulfonylamino]heptanoate Traditional Name: 7-[[(E)-5-hydroxy-5-(1-propylcyclobutyl)pent-2-enyl]-mesyl-amino]enanthic acid ethyl ester Formula: C22H41NO5S MolecularWeight: 431.62964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H41NO5S/c1-4-15-22(16-12-17-22)20(24)13-9-11-19-23(29(3,26)27)18-10-7-6-8-14-21(25)28-5-2/h9,11,20,24H,4-8,10,12-19H2,1-3H3/b11-9+