1-[4-chloranyl-2-(2-methylpropyl)phenyl]-3-cyclopropyl-propane-1,3-dione; methanesulfonamide

Systemtic Name: 1-[4-chloranyl-2-(2-methylpropyl)phenyl]-3-cyclopropyl-propane-1,3-dione; methanesulfonamide Openeye Name: 1-(4-chloro-2-isobutyl-phenyl)-3-cyclopropyl-propane-1,3-dione; methanesulfonamide CAS Name: 1-[4-chloro-2-(2-methylpropyl)phenyl]-3-cyclopropylpropane-1,3-dione; methanesulfonamide IUPAC Name: 1-[4-chloro-2-(2-methylpropyl)phenyl]-3-cyclopropylpropane-1,3-dione; methanesulfonamide Traditional Name: 1-(4-chloro-2-isobutyl-phenyl)-3-cyclopropyl-propane-1,3-dione; methanesulfonamide Formula: C17H24ClNO4S MolecularWeight: 373.89476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)Cl)C(=O)CC(=O)C2CC2.CS(=O)(=O)N

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)Cl)C(=O)CC(=O)C2CC2.CS(=O)(=O)N

InChI

InChI=1S/C16H19ClO2.CH5NO2S/c1-10(2)7-12-8-13(17)5-6-14(12)16(19)9-15(18)11-3-4-11;1-5(2,3)4/h5-6,8,10-11H,3-4,7,9H2,1-2H3;1H3,(H2,2,3,4)