S-octyl 4-bromanylbenzenecarbothioate

Systemtic Name: S-octyl 4-bromanylbenzenecarbothioate Openeye Name: S-octyl 4-bromobenzenecarbothioate CAS Name: 4-bromobenzenecarbothioic acid S-octyl ester IUPAC Name: S-octyl 4-bromobenzenecarbothioate Traditional Name: 4-bromothiobenzoic acid S-octyl ester Formula: C15H21BrOS MolecularWeight: 329.29564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCCCCSC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C15H21BrOS/c1-2-3-4-5-6-7-12-18-15(17)13-8-10-14(16)11-9-13/h8-11H,2-7,12H2,1H3