1-naphthalen-2-ylsulfonyl-4-(1-propylpiperidin-1-ium-4-yl)piperazin-4-ium

Systemtic Name: 1-naphthalen-2-ylsulfonyl-4-(1-propylpiperidin-1-ium-4-yl)piperazin-4-ium Openeye Name: 1-(2-naphthylsulfonyl)-4-(1-propylpiperidin-1-ium-4-yl)piperazin-4-ium CAS Name: 1-(2-naphthalenylsulfonyl)-4-(1-propyl-4-piperidin-1-iumyl)piperazin-4-ium IUPAC Name: 1-naphthalen-2-ylsulfonyl-4-(1-propylpiperidin-1-ium-4-yl)piperazin-4-ium Traditional Name: 1-(2-naphthylsulfonyl)-4-(1-propylpiperidin-1-ium-4-yl)piperazin-4-ium Formula: C22H33N3O2S+2 MolecularWeight: 403.58132

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC[NH+]1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H31N3O2S/c1-2-11-23-12-9-21(10-13-23)24-14-16-25(17-15-24)28(26,27)22-8-7-19-5-3-4-6-20(19)18-22/h3-8,18,21H,2,9-17H2,1H3/p+2