4-(phenylsulfonyl)butyl 11-bromanylundecanoate

Systemtic Name: 4-(phenylsulfonyl)butyl 11-bromanylundecanoate Openeye Name: 4-(benzenesulfonyl)butyl 11-bromoundecanoate CAS Name: 11-bromoundecanoic acid 4-(benzenesulfonyl)butyl ester IUPAC Name: 4-(benzenesulfonyl)butyl 11-bromoundecanoate Traditional Name: 11-bromoundecanoic acid 4-besylbutyl ester Formula: C21H33BrO4S MolecularWeight: 461.45332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCCCOC(=O)CCCCCCCCCCBr

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCCCOC(=O)CCCCCCCCCCBr

InChI

InChI=1S/C21H33BrO4S/c22-17-11-6-4-2-1-3-5-10-16-21(23)26-18-12-13-19-27(24,25)20-14-8-7-9-15-20/h7-9,14-15H,1-6,10-13,16-19H2