2-ethyl-2-[[4-methoxy-2-(phenylcarbonyl)phenyl]sulfanylmethyl]hexanal

Systemtic Name: 2-ethyl-2-[[4-methoxy-2-(phenylcarbonyl)phenyl]sulfanylmethyl]hexanal Openeye Name: 2-[(2-benzoyl-4-methoxy-phenyl)sulfanylmethyl]-2-ethyl-hexanal CAS Name: 2-[[(2-benzoyl-4-methoxyphenyl)thio]methyl]-2-ethylhexanal IUPAC Name: 2-[(2-benzoyl-4-methoxyphenyl)sulfanylmethyl]-2-ethylhexanal Traditional Name: 2-[[(2-benzoyl-4-methoxy-phenyl)thio]methyl]-2-ethyl-hexanal Formula: C23H28O3S MolecularWeight: 384.53162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CSC1=C(C=C(C=C1)OC)C(=O)C2=CC=CC=C2)C=O

Isomeric SMILES

CCCCC(CC)(CSC1=C(C=C(C=C1)OC)C(=O)C2=CC=CC=C2)C=O

InChI

InChI=1S/C23H28O3S/c1-4-6-14-23(5-2,16-24)17-27-21-13-12-19(26-3)15-20(21)22(25)18-10-8-7-9-11-18/h7-13,15-16H,4-6,14,17H2,1-3H3