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3-ethyl-2-(3-oxidanylidenepropyl)-2-(phenylsulfonylamino)undecanoic acid

3-ethyl-2-(3-oxidanylidenepropyl)-2-(phenylsulfonylamino)undecanoic acid

Systemtic Name:3-ethyl-2-(3-oxidanylidenepropyl)-2-(phenylsulfonylamino)undecanoic acid
Openeye Name:2-(benzenesulfonamido)-3-ethyl-2-(3-oxopropyl)undecanoic acid
CAS Name:2-(benzenesulfonamido)-3-ethyl-2-(3-oxopropyl)undecanoic acid
IUPAC Name:2-(benzenesulfonamido)-3-ethyl-2-(3-oxopropyl)undecanoic acid
Traditional Name:2-(benzenesulfonamido)-3-ethyl-2-(3-ketopropyl)undecanoic acid
Formula: C22H35NO5S
MolecularWeight: 425.582
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC)C(CCC=O)(C(=O)O)NS(=O)(=O)C1=CC=CC=C1


Isomeric SMILES

CCCCCCCCC(CC)C(CCC=O)(C(=O)O)NS(=O)(=O)C1=CC=CC=C1


InChI

InChI=1S/C22H35NO5S/c1-3-5-6-7-8-10-14-19(4-2)22(21(25)26,17-13-18-24)23-29(27,28)20-15-11-9-12-16-20/h9,11-12,15-16,18-19,23H,3-8,10,13-14,17H2,1-2H3,(H,25,26)


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