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

Systemtic Name: 4-(2-ethylhexanoylamino)-3-methyl-benzenesulfonyl chloride Openeye Name: 4-(2-ethylhexanoylamino)-3-methyl-benzenesulfonyl chloride CAS Name: 4-[(2-ethyl-1-oxohexyl)amino]-3-methylbenzenesulfonyl chloride IUPAC Name: 4-(2-ethylhexanoylamino)-3-methylbenzenesulfonyl chloride Traditional Name: 4-(2-ethylhexanoylamino)-3-methyl-benzenesulfonyl chloride Formula: C15H22ClNO3S MolecularWeight: 331.85808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)C

Isomeric SMILES

CCCCC(CC)C(=O)NC1=C(C=C(C=C1)S(=O)(=O)Cl)C

InChI

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