N-[3-[[4-(1H-indol-3-yl)butylamino]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]methanesulfonamide

Systemtic Name: N-[3-[[4-(1H-indol-3-yl)butylamino]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]methanesulfonamide Openeye Name: N-[3-[[4-(1H-indol-3-yl)butylamino]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]methanesulfonamide CAS Name: N-[3-[[4-(1H-indol-3-yl)butylamino]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]methanesulfonamide IUPAC Name: N-[3-[[4-(1H-indol-3-yl)butylamino]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]methanesulfonamide Traditional Name: N-[3-[[4-(1H-indol-3-yl)butylamino]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]methanesulfonamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC2=C(C=C1)OCC(O2)CNCCCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CS(=O)(=O)NC1=CC2=C(C=C1)OCC(O2)CNCCCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H27N3O4S/c1-30(26,27)25-17-9-10-21-22(12-17)29-18(15-28-21)14-23-11-5-4-6-16-13-24-20-8-3-2-7-19(16)20/h2-3,7-10,12-13,18,23-25H,4-6,11,14-15H2,1H3