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14-oxidanylidene-14-[[2-(5-sulfinopentoxy)phenyl]amino]tetradecanoic acid

14-oxidanylidene-14-[[2-(5-sulfinopentoxy)phenyl]amino]tetradecanoic acid

Systemtic Name:14-oxidanylidene-14-[[2-(5-sulfinopentoxy)phenyl]amino]tetradecanoic acid
Openeye Name:14-oxo-14-[2-(5-sulfinopentoxy)anilino]tetradecanoic acid
CAS Name:14-oxo-14-[2-(5-sulfinopentoxy)anilino]tetradecanoic acid
IUPAC Name:14-oxo-14-[2-(5-sulfinopentoxy)anilino]tetradecanoic acid
Traditional Name:14-keto-14-[2-(5-sulfinopentoxy)anilino]myristic acid
Formula: C25H41NO6S
MolecularWeight: 483.66114
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCCCCCCCCCCCC(=O)O)OCCCCCS(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCCCCCCCCCCCC(=O)O)OCCCCCS(=O)O


InChI

InChI=1S/C25H41NO6S/c27-24(18-10-7-5-3-1-2-4-6-8-11-19-25(28)29)26-22-16-12-13-17-23(22)32-20-14-9-15-21-33(30)31/h12-13,16-17H,1-11,14-15,18-21H2,(H,26,27)(H,28,29)(H,30,31)


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