[6-methoxy-4-methylidene-6-(2,6,6-trimethyl-5-prop-2-enoyl-cyclohexen-1-yl)hexyl] 4-methylbenzenesulfonate

Systemtic Name: [6-methoxy-4-methylidene-6-(2,6,6-trimethyl-5-prop-2-enoyl-cyclohexen-1-yl)hexyl] 4-methylbenzenesulfonate Openeye Name: [6-methoxy-4-methylene-6-(2,6,6-trimethyl-5-prop-2-enoyl-cyclohexen-1-yl)hexyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [6-methoxy-4-methylene-6-[2,6,6-trimethyl-5-(1-oxoprop-2-enyl)-1-cyclohexenyl]hexyl] ester IUPAC Name: [6-methoxy-4-methylidene-6-(2,6,6-trimethyl-5-prop-2-enoylcyclohexen-1-yl)hexyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-[2-(5-acryloyl-2,6,6-trimethyl-cyclohexen-1-yl)-2-methoxy-ethyl]pent-4-enyl ester Formula: C27H38O5S MolecularWeight: 474.65262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CC1)C(=O)C=C)(C)C)C(CC(=C)CCCOS(=O)(=O)C2=CC=C(C=C2)C)OC

Isomeric SMILES

CC1=C(C(C(CC1)C(=O)C=C)(C)C)C(CC(=C)CCCOS(=O)(=O)C2=CC=C(C=C2)C)OC

InChI

InChI=1S/C27H38O5S/c1-8-24(28)23-16-13-21(4)26(27(23,5)6)25(31-7)18-20(3)10-9-17-32-33(29,30)22-14-11-19(2)12-15-22/h8,11-12,14-15,23,25H,1,3,9-10,13,16-18H2,2,4-7H3