(E)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-(4-indan-5-ylsulfonylpiperazin-1-yl)but-2-en-1-one CAS Name: (E)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-(4-indan-5-ylsulfonylpiperazino)but-2-en-1-one Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C17H22N2O3S/c1-2-4-17(20)18-9-11-19(12-10-18)23(21,22)16-8-7-14-5-3-6-15(14)13-16/h2,4,7-8,13H,3,5-6,9-12H2,1H3/b4-2+