(4,4-dimethylcyclohexa-1,5-dien-1-yl) benzenesulfonate

Systemtic Name: (4,4-dimethylcyclohexa-1,5-dien-1-yl) benzenesulfonate Openeye Name: (4,4-dimethylcyclohexa-1,5-dien-1-yl) benzenesulfonate CAS Name: benzenesulfonic acid (4,4-dimethyl-1-cyclohexa-1,5-dienyl) ester IUPAC Name: (4,4-dimethylcyclohexa-1,5-dien-1-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (4,4-dimethylcyclohexa-1,5-dien-1-yl) ester Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3S/c1-14(2)10-8-12(9-11-14)17-18(15,16)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3