N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromanyl-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-bromo-2,4,6-trimethylbenzenesulfonamide Traditional Name: 3-bromo-2,4,6-trimethyl-N-piperonyl-benzenesulfonamide Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C)Br)C

InChI

InChI=1S/C17H18BrNO4S/c1-10-6-11(2)17(12(3)16(10)18)24(20,21)19-8-13-4-5-14-15(7-13)23-9-22-14/h4-7,19H,8-9H2,1-3H3