3-(1,3-benzodioxol-5-yl)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-(4-indan-5-ylsulfonylpiperazin-1-yl)propan-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-(4-indan-5-ylsulfonylpiperazino)propan-1-one Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N2O5S/c26-23(9-5-17-4-8-21-22(14-17)30-16-29-21)24-10-12-25(13-11-24)31(27,28)20-7-6-18-2-1-3-19(18)15-20/h4,6-8,14-15H,1-3,5,9-13,16H2