3-(2-chlorophenyl)sulfanyl-3,7-dimethyl-oct-6-enal

Systemtic Name: 3-(2-chlorophenyl)sulfanyl-3,7-dimethyl-oct-6-enal Openeye Name: 3-(2-chlorophenyl)sulfanyl-3,7-dimethyl-oct-6-enal CAS Name: 3-[(2-chlorophenyl)thio]-3,7-dimethyl-6-octenal IUPAC Name: 3-(2-chlorophenyl)sulfanyl-3,7-dimethyloct-6-enal Traditional Name: 3-[(2-chlorophenyl)thio]-3,7-dimethyl-oct-6-enal Formula: C16H21ClOS MolecularWeight: 296.85534

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(C)(CC=O)SC1=CC=CC=C1Cl)C

Isomeric SMILES

CC(=CCCC(C)(CC=O)SC1=CC=CC=C1Cl)C

InChI

InChI=1S/C16H21ClOS/c1-13(2)7-6-10-16(3,11-12-18)19-15-9-5-4-8-14(15)17/h4-5,7-9,12H,6,10-11H2,1-3H3