1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[(4-besylpiperazin-1-ium-1-yl)methyl]-2-naphthol Formula: C21H23N2O3S+ MolecularWeight: 383.48392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=CC=CC=C32)O)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=CC=CC=C32)O)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O3S/c24-21-11-10-17-6-4-5-9-19(17)20(21)16-22-12-14-23(15-13-22)27(25,26)18-7-2-1-3-8-18/h1-11,24H,12-16H2/p+1