N-[[2-(dipropylamino)-2,3-dihydro-1H-inden-5-yl]methyl]-4-iodanyl-benzenesulfonamide

Systemtic Name: N-[[2-(dipropylamino)-2,3-dihydro-1H-inden-5-yl]methyl]-4-iodanyl-benzenesulfonamide Openeye Name: N-[[2-(dipropylamino)indan-5-yl]methyl]-4-iodo-benzenesulfonamide CAS Name: N-[[2-(dipropylamino)-2,3-dihydro-1H-inden-5-yl]methyl]-4-iodobenzenesulfonamide IUPAC Name: N-[[2-(dipropylamino)-2,3-dihydro-1H-inden-5-yl]methyl]-4-iodobenzenesulfonamide Traditional Name: N-[[2-(dipropylamino)indan-5-yl]methyl]-4-iodo-benzenesulfonamide Formula: C22H29IN2O2S MolecularWeight: 512.44733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1CC2=C(C1)C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)I

Isomeric SMILES

CCCN(CCC)C1CC2=C(C1)C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C22H29IN2O2S/c1-3-11-25(12-4-2)21-14-18-6-5-17(13-19(18)15-21)16-24-28(26,27)22-9-7-20(23)8-10-22/h5-10,13,21,24H,3-4,11-12,14-16H2,1-2H3