1-(2-methoxyphenyl)-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperazin-4-ium

Systemtic Name: 1-(2-methoxyphenyl)-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperazin-4-ium Openeye Name: 1-(2-methoxyphenyl)-4-[1-(2-naphthylsulfonyl)-4-piperidyl]piperazin-4-ium CAS Name: 1-(2-methoxyphenyl)-4-[1-(2-naphthalenylsulfonyl)-4-piperidinyl]piperazin-4-ium IUPAC Name: 1-(2-methoxyphenyl)-4-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)piperazin-4-ium Traditional Name: 1-(2-methoxyphenyl)-4-[1-(2-naphthylsulfonyl)-4-piperidyl]piperazin-4-ium Formula: C26H32N3O3S+ MolecularWeight: 466.61558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H31N3O3S/c1-32-26-9-5-4-8-25(26)28-18-16-27(17-19-28)23-12-14-29(15-13-23)33(30,31)24-11-10-21-6-2-3-7-22(21)20-24/h2-11,20,23H,12-19H2,1H3/p+1