1-(4-chloranyl-2-methyl-phenyl)-3-cyclopropyl-propane-1,3-dione; methanesulfonamide

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-cyclopropyl-propane-1,3-dione; methanesulfonamide Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-cyclopropyl-propane-1,3-dione; methanesulfonamide CAS Name: 1-(4-chloro-2-methylphenyl)-3-cyclopropylpropane-1,3-dione; methanesulfonamide IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-cyclopropylpropane-1,3-dione; methanesulfonamide Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-cyclopropyl-propane-1,3-dione; methanesulfonamide Formula: C14H18ClNO4S MolecularWeight: 331.81502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClO2.CH5NO2S/c1-8-6-10(14)4-5-11(8)13(16)7-12(15)9-2-3-9;1-5(2,3)4/h4-6,9H,2-3,7H2,1H3;1H3,(H2,2,3,4)