3-methyl-4-(2-methylpentanoylamino)benzenesulfonyl chloride

Systemtic Name: 3-methyl-4-(2-methylpentanoylamino)benzenesulfonyl chloride Openeye Name: 3-methyl-4-(2-methylpentanoylamino)benzenesulfonyl chloride CAS Name: 3-methyl-4-[(2-methyl-1-oxopentyl)amino]benzenesulfonyl chloride IUPAC Name: 3-methyl-4-(2-methylpentanoylamino)benzenesulfonyl chloride Traditional Name: 3-methyl-4-(2-methylpentanoylamino)benzenesulfonyl chloride Formula: C13H18ClNO3S MolecularWeight: 303.80492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)C

Isomeric SMILES

CCCC(C)C(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)C

InChI

InChI=1S/C13H18ClNO3S/c1-4-5-9(2)13(16)15-12-7-6-11(8-10(12)3)19(14,17)18/h6-9H,4-5H2,1-3H3,(H,15,16)