spiro[5.5]undecan-11-ylmethyl 4-methylbenzenesulfonate

Systemtic Name: spiro[5.5]undecan-11-ylmethyl 4-methylbenzenesulfonate Openeye Name: spiro[5.5]undecan-11-ylmethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 11-spiro[5.5]undecanylmethyl ester IUPAC Name: spiro[5.5]undecan-11-ylmethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid spiro[5.5]undecan-11-ylmethyl ester Formula: C19H28O3S MolecularWeight: 336.48882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCCCC23CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCCCC23CCCCC3

InChI

InChI=1S/C19H28O3S/c1-16-8-10-18(11-9-16)23(20,21)22-15-17-7-3-6-14-19(17)12-4-2-5-13-19/h8-11,17H,2-7,12-15H2,1H3