(4S,5R)-4-methyl-6-methylidene-5-(4-methylphenyl)sulfonyl-oxepan-2-one

Systemtic Name: (4S,5R)-4-methyl-6-methylidene-5-(4-methylphenyl)sulfonyl-oxepan-2-one Openeye Name: (4S,5R)-4-methyl-6-methylene-5-(p-tolylsulfonyl)oxepan-2-one CAS Name: (4S,5R)-4-methyl-6-methylene-5-(4-methylphenyl)sulfonyl-2-oxepanone IUPAC Name: (4S,5R)-4-methyl-6-methylidene-5-(4-methylphenyl)sulfonyloxepan-2-one Traditional Name: (4S,5R)-4-methyl-6-methylene-5-tosyl-oxepan-2-one Formula: C15H18O4S MolecularWeight: 294.36602

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)OCC(=C)C1S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

C[C@H]1CC(=O)OCC(=C)[C@@H]1S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H18O4S/c1-10-4-6-13(7-5-10)20(17,18)15-11(2)8-14(16)19-9-12(15)3/h4-7,11,15H,3,8-9H2,1-2H3/t11-,15+/m0/s1