2-(4-but-2-ynoxyphenyl)sulfanyl-N-oxidanyl-octanamide

Systemtic Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-N-oxidanyl-octanamide Openeye Name: 2-(4-but-2-ynoxyphenyl)sulfanyloctanehydroxamic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)thio]-N-hydroxyoctanamide IUPAC Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-N-hydroxyoctanamide Traditional Name: 2-[(4-but-2-ynoxyphenyl)thio]octanehydroxamic acid Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)NO)SC1=CC=C(C=C1)OCC#CC

Isomeric SMILES

CCCCCCC(C(=O)NO)SC1=CC=C(C=C1)OCC#CC

InChI

InChI=1S/C18H25NO3S/c1-3-5-7-8-9-17(18(20)19-21)23-16-12-10-15(11-13-16)22-14-6-4-2/h10-13,17,21H,3,5,7-9,14H2,1-2H3,(H,19,20)