1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanone

Systemtic Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanone Openeye Name: 1-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanone CAS Name: 1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanone IUPAC Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanone Traditional Name: 1-[4-(2-naphthylsulfonyl)piperazino]-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanone Formula: C27H30N3O3S+ MolecularWeight: 476.6104

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC=C1C2=CC=CC=C2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1C[NH+](CC=C1C2=CC=CC=C2)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H29N3O3S/c31-27(21-28-14-12-24(13-15-28)22-6-2-1-3-7-22)29-16-18-30(19-17-29)34(32,33)26-11-10-23-8-4-5-9-25(23)20-26/h1-12,20H,13-19,21H2/p+1