1-[5-(4-methylphenyl)sulfonyloxy-2-oxidanylidene-1,3a,4,5,6,6a-hexahydrocyclopenta[d]imidazol-3-yl]octan-3-yl ethanoate

Systemtic Name: 1-[5-(4-methylphenyl)sulfonyloxy-2-oxidanylidene-1,3a,4,5,6,6a-hexahydrocyclopenta[d]imidazol-3-yl]octan-3-yl ethanoate Openeye Name: 1-[2-[2-oxo-5-(p-tolylsulfonyloxy)-1,3a,4,5,6,6a-hexahydrocyclopenta[d]imidazol-3-yl]ethyl]hexyl acetate CAS Name: acetic acid 1-[5-(4-methylphenyl)sulfonyloxy-2-oxo-1,3a,4,5,6,6a-hexahydrocyclopenta[d]imidazol-3-yl]octan-3-yl ester IUPAC Name: 1-[5-(4-methylphenyl)sulfonyloxy-2-oxo-1,3a,4,5,6,6a-hexahydrocyclopenta[d]imidazol-3-yl]octan-3-yl acetate Traditional Name: acetic acid 1-[2-(2-keto-5-tosyloxy-1,3a,4,5,6,6a-hexahydrocyclopent[d]imidazol-3-yl)ethyl]hexyl ester Formula: C23H34N2O6S MolecularWeight: 466.59086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCN1C2CC(CC2NC1=O)OS(=O)(=O)C3=CC=C(C=C3)C)OC(=O)C

Isomeric SMILES

CCCCCC(CCN1C2CC(CC2NC1=O)OS(=O)(=O)C3=CC=C(C=C3)C)OC(=O)C

InChI

InChI=1S/C23H34N2O6S/c1-4-5-6-7-18(30-17(3)26)12-13-25-22-15-19(14-21(22)24-23(25)27)31-32(28,29)20-10-8-16(2)9-11-20/h8-11,18-19,21-22H,4-7,12-15H2,1-3H3,(H,24,27)