7-(5,5-dimethyl-6-oxidanylidene-7-phenyl-heptyl)sulfanyl-3,3-dimethyl-1-phenyl-heptan-2-one

Systemtic Name: 7-(5,5-dimethyl-6-oxidanylidene-7-phenyl-heptyl)sulfanyl-3,3-dimethyl-1-phenyl-heptan-2-one Openeye Name: 7-(5,5-dimethyl-6-oxo-7-phenyl-heptyl)sulfanyl-3,3-dimethyl-1-phenyl-heptan-2-one CAS Name: 7-[(5,5-dimethyl-6-oxo-7-phenylheptyl)thio]-3,3-dimethyl-1-phenyl-2-heptanone IUPAC Name: 7-(5,5-dimethyl-6-oxo-7-phenylheptyl)sulfanyl-3,3-dimethyl-1-phenylheptan-2-one Traditional Name: 7-[(6-keto-5,5-dimethyl-7-phenyl-heptyl)thio]-3,3-dimethyl-1-phenyl-heptan-2-one Formula: C30H42O2S MolecularWeight: 466.71828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCSCCCCC(C)(C)C(=O)CC1=CC=CC=C1)C(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(CCCCSCCCCC(C)(C)C(=O)CC1=CC=CC=C1)C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C30H42O2S/c1-29(2,27(31)23-25-15-7-5-8-16-25)19-11-13-21-33-22-14-12-20-30(3,4)28(32)24-26-17-9-6-10-18-26/h5-10,15-18H,11-14,19-24H2,1-4H3