(4-pentylcyclohex-3-en-1-yl)methyl 2-methylbenzenesulfonate

Systemtic Name: (4-pentylcyclohex-3-en-1-yl)methyl 2-methylbenzenesulfonate Openeye Name: (4-pentylcyclohex-3-en-1-yl)methyl 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid (4-pentyl-1-cyclohex-3-enyl)methyl ester IUPAC Name: (4-pentylcyclohex-3-en-1-yl)methyl 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid (4-amylcyclohex-3-en-1-yl)methyl ester Formula: C19H28O3S MolecularWeight: 336.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CCC(CC1)COS(=O)(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCCCC1=CCC(CC1)COS(=O)(=O)C2=CC=CC=C2C

InChI

InChI=1S/C19H28O3S/c1-3-4-5-9-17-11-13-18(14-12-17)15-22-23(20,21)19-10-7-6-8-16(19)2/h6-8,10-11,18H,3-5,9,12-15H2,1-2H3