1-[3-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-(4-indan-5-ylsulfonylpiperazin-1-yl)sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-(4-indan-5-ylsulfonylpiperazino)sulfonylphenyl]ethanone Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H24N2O5S2/c1-16(24)18-5-3-7-20(14-18)29(25,26)22-10-12-23(13-11-22)30(27,28)21-9-8-17-4-2-6-19(17)15-21/h3,5,7-9,14-15H,2,4,6,10-13H2,1H3