N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-phenethyl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-phenethyl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-phenethyl-amino]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-phenethylamino]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-bromophenyl)sulfonyl-phenethylamino]acetamide Traditional Name: 2-[brosyl(phenethyl)amino]-N-piperonyl-acetamide Formula: C24H23BrN2O5S MolecularWeight: 531.41882

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H23BrN2O5S/c25-20-7-9-21(10-8-20)33(29,30)27(13-12-18-4-2-1-3-5-18)16-24(28)26-15-19-6-11-22-23(14-19)32-17-31-22/h1-11,14H,12-13,15-17H2,(H,26,28)