2-piperazin-4-ium-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-piperazin-4-ium-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-piperazin-4-ium-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(1-piperazin-4-iumylsulfonyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-piperazin-4-ium-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-piperazin-4-ium-1-ylsulfonyl-3,4-dihydro-1H-isoquinoline Formula: C13H20N3O2S+ MolecularWeight: 282.3818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)N3CC[NH2+]CC3

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C13H19N3O2S/c17-19(18,15-9-6-14-7-10-15)16-8-5-12-3-1-2-4-13(12)11-16/h1-4,14H,5-11H2/p+1