4-(1,3-benzodioxol-5-ylsulfonyl)-4-methyl-pentan-2-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylsulfonyl)-4-methyl-pentan-2-one Openeye Name: 4-(1,3-benzodioxol-5-ylsulfonyl)-4-methyl-pentan-2-one CAS Name: 4-(1,3-benzodioxol-5-ylsulfonyl)-4-methyl-2-pentanone IUPAC Name: 4-(1,3-benzodioxol-5-ylsulfonyl)-4-methylpentan-2-one Traditional Name: 4-(1,3-benzodioxol-5-ylsulfonyl)-4-methyl-pentan-2-one Formula: C13H16O5S MolecularWeight: 284.32814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)S(=O)(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(=O)CC(C)(C)S(=O)(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H16O5S/c1-9(14)7-13(2,3)19(15,16)10-4-5-11-12(6-10)18-8-17-11/h4-6H,7-8H2,1-3H3