N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-propan-2-ylsulfonyl-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-propan-2-ylsulfonyl-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-isopropylsulfonyl-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-propan-2-ylsulfonylbenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-propan-2-ylsulfonylbenzamide Traditional Name: N-homopiperonyl-4-isopropylsulfonyl-benzamide Formula: C19H21NO5S MolecularWeight: 375.43874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H21NO5S/c1-13(2)26(22,23)16-6-4-15(5-7-16)19(21)20-10-9-14-3-8-17-18(11-14)25-12-24-17/h3-8,11,13H,9-10,12H2,1-2H3,(H,20,21)