[(2E)-2-[2-methyl-2-(2-phenylmethoxyethyl)cyclobutylidene]propyl] 4-methylbenzenesulfonate

Systemtic Name: [(2E)-2-[2-methyl-2-(2-phenylmethoxyethyl)cyclobutylidene]propyl] 4-methylbenzenesulfonate Openeye Name: [(2E)-2-[2-(2-benzyloxyethyl)-2-methyl-cyclobutylidene]propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2E)-2-[2-methyl-2-(2-phenylmethoxyethyl)cyclobutylidene]propyl] ester IUPAC Name: [(2E)-2-[2-methyl-2-(2-phenylmethoxyethyl)cyclobutylidene]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2E)-2-[2-(2-benzoxyethyl)-2-methyl-cyclobutylidene]propyl] ester Formula: C24H30O4S MolecularWeight: 414.5576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=C2CCC2(C)CCOCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC/C(=C/2\CCC2(C)CCOCC3=CC=CC=C3)/C

InChI

InChI=1S/C24H30O4S/c1-19-9-11-22(12-10-19)29(25,26)28-17-20(2)23-13-14-24(23,3)15-16-27-18-21-7-5-4-6-8-21/h4-12H,13-18H2,1-3H3/b23-20+