3-ethyl-5-methyl-4-(4-methylpentanoylamino)benzenesulfonyl chloride

Systemtic Name: 3-ethyl-5-methyl-4-(4-methylpentanoylamino)benzenesulfonyl chloride Openeye Name: 3-ethyl-5-methyl-4-(4-methylpentanoylamino)benzenesulfonyl chloride CAS Name: 3-ethyl-5-methyl-4-[(4-methyl-1-oxopentyl)amino]benzenesulfonyl chloride IUPAC Name: 3-ethyl-5-methyl-4-(4-methylpentanoylamino)benzenesulfonyl chloride Traditional Name: 3-ethyl-5-methyl-4-(4-methylpentanoylamino)benzenesulfonyl chloride Formula: C15H22ClNO3S MolecularWeight: 331.85808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)S(=O)(=O)Cl)C)NC(=O)CCC(C)C

Isomeric SMILES

CCC1=C(C(=CC(=C1)S(=O)(=O)Cl)C)NC(=O)CCC(C)C

InChI

InChI=1S/C15H22ClNO3S/c1-5-12-9-13(21(16,19)20)8-11(4)15(12)17-14(18)7-6-10(2)3/h8-10H,5-7H2,1-4H3,(H,17,18)