9-bromanylnonyl 4-methylbenzenesulfonate

Systemtic Name: 9-bromanylnonyl 4-methylbenzenesulfonate Openeye Name: 9-bromononyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 9-bromononyl ester IUPAC Name: 9-bromononyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 9-bromononyl ester Formula: C16H25BrO3S MolecularWeight: 377.3369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25BrO3S/c1-15-9-11-16(12-10-15)21(18,19)20-14-8-6-4-2-3-5-7-13-17/h9-12H,2-8,13-14H2,1H3