2-methyl-7-(6-methyl-7-oxidanylidene-6-phenyl-heptyl)sulfanyl-2-phenyl-heptanal

Systemtic Name: 2-methyl-7-(6-methyl-7-oxidanylidene-6-phenyl-heptyl)sulfanyl-2-phenyl-heptanal Openeye Name: 2-methyl-7-(6-methyl-7-oxo-6-phenyl-heptyl)sulfanyl-2-phenyl-heptanal CAS Name: 2-methyl-7-[(6-methyl-7-oxo-6-phenylheptyl)thio]-2-phenylheptanal IUPAC Name: 2-methyl-7-(6-methyl-7-oxo-6-phenylheptyl)sulfanyl-2-phenylheptanal Traditional Name: 7-[(7-keto-6-methyl-6-phenyl-heptyl)thio]-2-methyl-2-phenyl-enanthaldehyde Formula: C28H38O2S MolecularWeight: 438.66512

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCSCCCCCC(C)(C=O)C1=CC=CC=C1)(C=O)C2=CC=CC=C2

Isomeric SMILES

CC(CCCCCSCCCCCC(C)(C=O)C1=CC=CC=C1)(C=O)C2=CC=CC=C2

InChI

InChI=1S/C28H38O2S/c1-27(23-29,25-15-7-3-8-16-25)19-11-5-13-21-31-22-14-6-12-20-28(2,24-30)26-17-9-4-10-18-26/h3-4,7-10,15-18,23-24H,5-6,11-14,19-22H2,1-2H3