N-(1,3-benzodioxol-5-ylmethyl)-N-[3-(dimethylamino)propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[3-(dimethylamino)propyl]-4-methyl-benzenesulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[3-(dimethylamino)propyl]-4-methyl-benzenesulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[3-(dimethylamino)propyl]-4-methylbenzenesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[3-(dimethylamino)propyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-(dimethylamino)propyl]-4-methyl-N-piperonyl-benzenesulfonamide Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCN(C)C)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCN(C)C)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H26N2O4S/c1-16-5-8-18(9-6-16)27(23,24)22(12-4-11-21(2)3)14-17-7-10-19-20(13-17)26-15-25-19/h5-10,13H,4,11-12,14-15H2,1-3H3