2-(2-butyl-2-methanoyl-hexyl)sulfanyl-5-fluoranyl-benzaldehyde

Systemtic Name: 2-(2-butyl-2-methanoyl-hexyl)sulfanyl-5-fluoranyl-benzaldehyde Openeye Name: 2-(2-butyl-2-formyl-hexyl)sulfanyl-5-fluoro-benzaldehyde CAS Name: 2-[(2-butyl-2-formylhexyl)thio]-5-fluorobenzaldehyde IUPAC Name: 2-(2-butyl-2-formylhexyl)sulfanyl-5-fluorobenzaldehyde Traditional Name: 2-[(2-butyl-2-formyl-hexyl)thio]-5-fluoro-benzaldehyde Formula: C18H25FO2S MolecularWeight: 324.453303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CSC1=C(C=C(C=C1)F)C=O)C=O

Isomeric SMILES

CCCCC(CCCC)(CSC1=C(C=C(C=C1)F)C=O)C=O

InChI

InChI=1S/C18H25FO2S/c1-3-5-9-18(13-21,10-6-4-2)14-22-17-8-7-16(19)11-15(17)12-20/h7-8,11-13H,3-6,9-10,14H2,1-2H3