N-(1,3-benzodioxol-5-ylmethyl)-4-bromanyl-3-propoxy-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromanyl-3-propoxy-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-3-propoxy-benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-3-propoxybenzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-3-propoxybenzenesulfonamide Traditional Name: 4-bromo-N-piperonyl-3-propoxy-benzenesulfonamide Formula: C17H18BrNO5S MolecularWeight: 428.29752

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CCCOC1=C(C=CC(=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C17H18BrNO5S/c1-2-7-22-16-9-13(4-5-14(16)18)25(20,21)19-10-12-3-6-15-17(8-12)24-11-23-15/h3-6,8-9,19H,2,7,10-11H2,1H3