1-[[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]methyl]naphthalen-2-ol CAS Name: 1-[[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]methyl]-2-naphthol Formula: C19H20ClN2O3S2+ MolecularWeight: 423.9567

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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=C(S4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=CC=CC=C32)O)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C19H19ClN2O3S2/c20-18-7-8-19(26-18)27(24,25)22-11-9-21(10-12-22)13-16-15-4-2-1-3-14(15)5-6-17(16)23/h1-8,23H,9-13H2/p+1