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S-dodecyl (3S)-5-oxidanylidene-3,5-diphenyl-pentanethioate

S-dodecyl (3S)-5-oxidanylidene-3,5-diphenyl-pentanethioate

Systemtic Name:S-dodecyl (3S)-5-oxidanylidene-3,5-diphenyl-pentanethioate
Openeye Name:S-dodecyl (3S)-5-oxo-3,5-diphenyl-pentanethioate
CAS Name:(3S)-5-oxo-3,5-diphenylpentanethioic acid S-dodecyl ester
IUPAC Name:S-dodecyl (3S)-5-oxo-3,5-diphenylpentanethioate
Traditional Name:(3S)-5-keto-3,5-diphenyl-pentanethioic acid S-lauryl ester
Formula: C29H40O2S
MolecularWeight: 452.6917
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(=O)CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCCSC(=O)C[C@H](CC(=O)C1=CC=CC=C1)C2=CC=CC=C2


InChI

InChI=1S/C29H40O2S/c1-2-3-4-5-6-7-8-9-10-17-22-32-29(31)24-27(25-18-13-11-14-19-25)23-28(30)26-20-15-12-16-21-26/h11-16,18-21,27H,2-10,17,22-24H2,1H3/t27-/m0/s1


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