2-(2-ethyl-2-methanoyl-hexyl)sulfanylbenzaldehyde

Systemtic Name: 2-(2-ethyl-2-methanoyl-hexyl)sulfanylbenzaldehyde Openeye Name: 2-(2-ethyl-2-formyl-hexyl)sulfanylbenzaldehyde CAS Name: 2-[(2-ethyl-2-formylhexyl)thio]benzaldehyde IUPAC Name: 2-(2-ethyl-2-formylhexyl)sulfanylbenzaldehyde Traditional Name: 2-[(2-ethyl-2-formyl-hexyl)thio]benzaldehyde Formula: C16H22O2S MolecularWeight: 278.40968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CSC1=CC=CC=C1C=O)C=O

Isomeric SMILES

CCCCC(CC)(CSC1=CC=CC=C1C=O)C=O

InChI

InChI=1S/C16H22O2S/c1-3-5-10-16(4-2,12-18)13-19-15-9-7-6-8-14(15)11-17/h6-9,11-12H,3-5,10,13H2,1-2H3