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The molecular formula is C14H14ClNO3S.
The molecular weight is 311.8 g/mol.
The IUPAC name is 5-(butanoylamino)naphthalene-1-sulfonyl chloride.
The InChI is InChI=1S/C14H14ClNO3S/c1-2-5-14(17)16-12-8-3-7-11-10(12)6-4-9-13(11)20(15,18)19/h3-4,6-9H,2,5H2,1H3,(H,16,17).
The InChIKey is ZYWSRQWFHZXWGL-UHFFFAOYSA-N.
The canonical SMILES is CCCC(=O)NC1=CC=CC2=C1C=CC=C2S(=O)(=O)Cl.
The CAS number is 728864-72-0.
The European Community (EC) number is 673-839-9.
The hydrogen bond donor count is 1.
Yes, it is a canonicalized compound according to PubChem.
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