1-naphthalen-2-ylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium

Systemtic Name: 1-naphthalen-2-ylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium Openeye Name: 1-(2-naphthylsulfonyl)-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium CAS Name: 1-(2-naphthalenylsulfonyl)-4-(4-pyridin-1-iumylmethyl)piperazin-4-ium IUPAC Name: 1-naphthalen-2-ylsulfonyl-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium Traditional Name: 1-(2-naphthylsulfonyl)-4-(pyridin-1-ium-4-ylmethyl)piperazin-4-ium Formula: C20H23N3O2S+2 MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=[NH+]C=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=[NH+]C=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H21N3O2S/c24-26(25,20-6-5-18-3-1-2-4-19(18)15-20)23-13-11-22(12-14-23)16-17-7-9-21-10-8-17/h1-10,15H,11-14,16H2/p+2