[4-(2-methylphenyl)-2-oxidanyl-butyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(2-methylphenyl)-2-oxidanyl-butyl] 4-methylbenzenesulfonate Openeye Name: [2-hydroxy-4-(o-tolyl)butyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-hydroxy-4-(2-methylphenyl)butyl] ester IUPAC Name: [2-hydroxy-4-(2-methylphenyl)butyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-hydroxy-4-(o-tolyl)butyl] ester Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCC2=CC=CC=C2C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(CCC2=CC=CC=C2C)O

InChI

InChI=1S/C18H22O4S/c1-14-7-11-18(12-8-14)23(20,21)22-13-17(19)10-9-16-6-4-3-5-15(16)2/h3-8,11-12,17,19H,9-10,13H2,1-2H3