undec-10-ynyl 4-methylbenzenesulfonate

Systemtic Name: undec-10-ynyl 4-methylbenzenesulfonate Openeye Name: undec-10-ynyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid undec-10-ynyl ester IUPAC Name: undec-10-ynyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid undec-10-ynyl ester Formula: C18H26O3S MolecularWeight: 322.46224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCCC#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCCCCCCC#C

InChI

InChI=1S/C18H26O3S/c1-3-4-5-6-7-8-9-10-11-16-21-22(19,20)18-14-12-17(2)13-15-18/h1,12-15H,4-11,16H2,2H3