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

Systemtic Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-(4-indan-5-ylsulfonylpiperazin-1-ium-1-yl)-1-morpholino-ethanone CAS Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazin-1-iumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-ium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-(4-indan-5-ylsulfonylpiperazin-1-ium-1-yl)-1-morpholino-ethanone Formula: C19H28N3O4S+ MolecularWeight: 394.50832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C19H27N3O4S/c23-19(21-10-12-26-13-11-21)15-20-6-8-22(9-7-20)27(24,25)18-5-4-16-2-1-3-17(16)14-18/h4-5,14H,1-3,6-13,15H2/p+1