N-[2-[4-[1-(4-chlorophenyl)sulfonylpyrazol-3-yl]phenoxy]ethyl]-N-methyl-pyridin-1-ium-2-amine

Systemtic Name: N-[2-[4-[1-(4-chlorophenyl)sulfonylpyrazol-3-yl]phenoxy]ethyl]-N-methyl-pyridin-1-ium-2-amine Openeye Name: N-[2-[4-[1-(4-chlorophenyl)sulfonylpyrazol-3-yl]phenoxy]ethyl]-N-methyl-pyridin-1-ium-2-amine CAS Name: N-[2-[4-[1-(4-chlorophenyl)sulfonyl-3-pyrazolyl]phenoxy]ethyl]-N-methyl-2-pyridin-1-iumamine IUPAC Name: N-[2-[4-[1-(4-chlorophenyl)sulfonylpyrazol-3-yl]phenoxy]ethyl]-N-methylpyridin-1-ium-2-amine Traditional Name: 2-[4-[1-(4-chlorophenyl)sulfonylpyrazol-3-yl]phenoxy]ethyl-methyl-pyridin-1-ium-2-yl-amine Formula: C23H22ClN4O3S+ MolecularWeight: 469.96378

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)C2=NN(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=[NH+]4

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)C2=NN(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=[NH+]4

InChI

InChI=1S/C23H21ClN4O3S/c1-27(23-4-2-3-14-25-23)16-17-31-20-9-5-18(6-10-20)22-13-15-28(26-22)32(29,30)21-11-7-19(24)8-12-21/h2-15H,16-17H2,1H3/p+1