3-(pentan-2-ylcarbamoyl)benzenesulfonyl chloride

Systemtic Name: 3-(pentan-2-ylcarbamoyl)benzenesulfonyl chloride Openeye Name: 3-(1-methylbutylcarbamoyl)benzenesulfonyl chloride CAS Name: 3-[oxo-(pentan-2-ylamino)methyl]benzenesulfonyl chloride IUPAC Name: 3-(pentan-2-ylcarbamoyl)benzenesulfonyl chloride Traditional Name: 3-(1-methylbutylcarbamoyl)benzenesulfonyl chloride Formula: C12H16ClNO3S MolecularWeight: 289.77834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1=CC(=CC=C1)S(=O)(=O)Cl

Isomeric SMILES

CCCC(C)NC(=O)C1=CC(=CC=C1)S(=O)(=O)Cl

InChI

InChI=1S/C12H16ClNO3S/c1-3-5-9(2)14-12(15)10-6-4-7-11(8-10)18(13,16)17/h4,6-9H,3,5H2,1-2H3,(H,14,15)