2,2-dimethyl-4-(4-methylphenyl)sulfonyl-butanal

Systemtic Name: 2,2-dimethyl-4-(4-methylphenyl)sulfonyl-butanal Openeye Name: 2,2-dimethyl-4-(p-tolylsulfonyl)butanal CAS Name: 2,2-dimethyl-4-(4-methylphenyl)sulfonylbutanal IUPAC Name: 2,2-dimethyl-4-(4-methylphenyl)sulfonylbutanal Traditional Name: 2,2-dimethyl-4-tosyl-butyraldehyde Formula: C13H18O3S MolecularWeight: 254.34522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3S/c1-11-4-6-12(7-5-11)17(15,16)9-8-13(2,3)10-14/h4-7,10H,8-9H2,1-3H3