1-(pyridin-2-ylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium

Systemtic Name: 1-(pyridin-2-ylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium Openeye Name: 1-(2-pyridylmethyl)-4-tetralin-6-ylsulfonyl-piperazin-1-ium CAS Name: 1-(2-pyridinylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium IUPAC Name: 1-(pyridin-2-ylmethyl)-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium Traditional Name: 1-(2-pyridylmethyl)-4-tetralin-6-ylsulfonyl-piperazin-1-ium Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C20H25N3O2S/c24-26(25,20-9-8-17-5-1-2-6-18(17)15-20)23-13-11-22(12-14-23)16-19-7-3-4-10-21-19/h3-4,7-10,15H,1-2,5-6,11-14,16H2/p+1