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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)Cl)NC(=O)CCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)Cl)NC(=O)CCC(C)C

InChI

InChI=1S/C13H18ClNO3S/c1-9(2)4-7-13(16)15-12-6-5-11(8-10(12)3)19(14,17)18/h5-6,8-9H,4,7H2,1-3H3,(H,15,16)