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nona-2,4,8-triynyl 4-methylbenzenesulfonate

nona-2,4,8-triynyl 4-methylbenzenesulfonate

Systemtic Name:nona-2,4,8-triynyl 4-methylbenzenesulfonate
Openeye Name:nona-2,4,8-triynyl 4-methylbenzenesulfonate
CAS Name:4-methylbenzenesulfonic acid nona-2,4,8-triynyl ester
IUPAC Name:nona-2,4,8-triynyl 4-methylbenzenesulfonate
Traditional Name:4-methylbenzenesulfonic acid nona-2,4,8-triynyl ester
Formula: C16H14O3S
MolecularWeight: 286.34556
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC#CC#CCCC#C


Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC#CC#CCCC#C


InChI

InChI=1S/C16H14O3S/c1-3-4-5-6-7-8-9-14-19-20(17,18)16-12-10-15(2)11-13-16/h1,10-13H,4-5,14H2,2H3


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