N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-bromophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-bromophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-bromophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-bromophenyl)sulfonyl-methylamino]acetamide Traditional Name: 2-[brosyl(methyl)amino]-N-homopiperonyl-acetamide Formula: C18H19BrN2O5S MolecularWeight: 455.32286

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCCC1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC(=O)NCCC1=CC2=C(C=C1)OCO2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrN2O5S/c1-21(27(23,24)15-5-3-14(19)4-6-15)11-18(22)20-9-8-13-2-7-16-17(10-13)26-12-25-16/h2-7,10H,8-9,11-12H2,1H3,(H,20,22)