N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-bromophenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-bromophenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-bromophenyl)sulfonylamino]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-bromophenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-bromophenyl)sulfonylamino]propanamide Traditional Name: 3-(brosylamino)-N-piperonyl-propionamide Formula: C17H17BrN2O5S MolecularWeight: 441.29628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN2O5S/c18-13-2-4-14(5-3-13)26(22,23)20-8-7-17(21)19-10-12-1-6-15-16(9-12)25-11-24-15/h1-6,9,20H,7-8,10-11H2,(H,19,21)