3-methyl-4-(pentanoylamino)-5-propan-2-yl-benzenesulfonyl chloride

Systemtic Name: 3-methyl-4-(pentanoylamino)-5-propan-2-yl-benzenesulfonyl chloride Openeye Name: 3-isopropyl-5-methyl-4-(pentanoylamino)benzenesulfonyl chloride CAS Name: 3-methyl-4-(1-oxopentylamino)-5-propan-2-ylbenzenesulfonyl chloride IUPAC Name: 3-methyl-4-(pentanoylamino)-5-propan-2-ylbenzenesulfonyl chloride Traditional Name: 3-isopropyl-5-methyl-4-(valerylamino)benzenesulfonyl chloride Formula: C15H22ClNO3S MolecularWeight: 331.85808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1C)S(=O)(=O)Cl)C(C)C

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1C)S(=O)(=O)Cl)C(C)C

InChI

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