N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-3-piperidin-1-ylcarbonyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-3-piperidin-1-ylcarbonyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-3-(piperidine-1-carbonyl)benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-3-[oxo(1-piperidinyl)methyl]benzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-3-(piperidine-1-carbonyl)benzenesulfonamide Traditional Name: 4-methyl-3-(piperidine-1-carbonyl)-N-piperonyl-benzenesulfonamide Formula: C21H24N2O5S MolecularWeight: 416.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)N4CCCCC4

InChI

InChI=1S/C21H24N2O5S/c1-15-5-7-17(12-18(15)21(24)23-9-3-2-4-10-23)29(25,26)22-13-16-6-8-19-20(11-16)28-14-27-19/h5-8,11-12,22H,2-4,9-10,13-14H2,1H3