1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(2-pyridin-2-ylethyl)piperazin-4-ium

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(2-pyridin-2-ylethyl)piperazin-4-ium Openeye Name: 1-indan-5-ylsulfonyl-4-[2-(2-pyridyl)ethyl]piperazin-4-ium CAS Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-[2-(2-pyridinyl)ethyl]piperazin-4-ium IUPAC Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(2-pyridin-2-ylethyl)piperazin-4-ium Traditional Name: 1-indan-5-ylsulfonyl-4-[2-(2-pyridyl)ethyl]piperazin-4-ium Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CCC4=CC=CC=N4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CCC4=CC=CC=N4

InChI

InChI=1S/C20H25N3O2S/c24-26(25,20-8-7-17-4-3-5-18(17)16-20)23-14-12-22(13-15-23)11-9-19-6-1-2-10-21-19/h1-2,6-8,10,16H,3-5,9,11-15H2/p+1