(5-methyl-2-propan-2-yl-phenyl) 4-tert-butylbenzenesulfonate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 4-tert-butylbenzenesulfonate Openeye Name: (2-isopropyl-5-methyl-phenyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C20H26O3S MolecularWeight: 346.48364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H26O3S/c1-14(2)18-12-7-15(3)13-19(18)23-24(21,22)17-10-8-16(9-11-17)20(4,5)6/h7-14H,1-6H3