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5-[(octanoylamino)methyl]thiophene-2-sulfonyl chloride

5-[(octanoylamino)methyl]thiophene-2-sulfonyl chloride

Systemtic Name:5-[(octanoylamino)methyl]thiophene-2-sulfonyl chloride
Openeye Name:5-[(octanoylamino)methyl]thiophene-2-sulfonyl chloride
CAS Name:5-[(1-oxooctylamino)methyl]-2-thiophenesulfonyl chloride
IUPAC Name:5-[(octanoylamino)methyl]thiophene-2-sulfonyl chloride
Traditional Name:5-[(caprylylamino)methyl]thiophene-2-sulfonyl chloride
Formula: C13H20ClNO3S2
MolecularWeight: 337.8858
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCC1=CC=C(S1)S(=O)(=O)Cl


Isomeric SMILES

CCCCCCCC(=O)NCC1=CC=C(S1)S(=O)(=O)Cl


InChI

InChI=1S/C13H20ClNO3S2/c1-2-3-4-5-6-7-12(16)15-10-11-8-9-13(19-11)20(14,17)18/h8-9H,2-7,10H2,1H3,(H,15,16)


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