2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[methyl(piperonyl)amino]acetamide Formula: C22H27N3O6S MolecularWeight: 461.53128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H27N3O6S/c1-16-3-5-18(12-21(16)32(27,28)25-7-9-29-10-8-25)23-22(26)14-24(2)13-17-4-6-19-20(11-17)31-15-30-19/h3-6,11-12H,7-10,13-15H2,1-2H3,(H,23,26)