N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenyl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenyl-pyridin-1-ium-3-sulfonamide Openeye Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenyl-pyridin-1-ium-3-sulfonamide CAS Name: N-ethyl-6-[4-(4-methoxyphenyl)-1-piperazinyl]-N-phenyl-3-pyridin-1-iumsulfonamide IUPAC Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-N-phenylpyridin-1-ium-3-sulfonamide Traditional Name: N-ethyl-6-[4-(4-methoxyphenyl)piperazino]-N-phenyl-pyridin-1-ium-3-sulfonamide Formula: C24H29N4O3S+ MolecularWeight: 453.57706

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H28N4O3S/c1-3-28(21-7-5-4-6-8-21)32(29,30)23-13-14-24(25-19-23)27-17-15-26(16-18-27)20-9-11-22(31-2)12-10-20/h4-14,19H,3,15-18H2,1-2H3/p+1