[5-(3,3-dimethyloxiran-2-yl)-3-methyl-pentyl] 4-methylbenzenesulfonate

Systemtic Name: [5-(3,3-dimethyloxiran-2-yl)-3-methyl-pentyl] 4-methylbenzenesulfonate Openeye Name: [5-(3,3-dimethyloxiran-2-yl)-3-methyl-pentyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-(3,3-dimethyl-2-oxiranyl)-3-methylpentyl] ester IUPAC Name: [5-(3,3-dimethyloxiran-2-yl)-3-methylpentyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5-(3,3-dimethyloxiran-2-yl)-3-methyl-pentyl] ester Formula: C17H26O4S MolecularWeight: 326.45094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCC2C(O2)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C)CCC2C(O2)(C)C

InChI

InChI=1S/C17H26O4S/c1-13-5-8-15(9-6-13)22(18,19)20-12-11-14(2)7-10-16-17(3,4)21-16/h5-6,8-9,14,16H,7,10-12H2,1-4H3