4-methoxy-N-[(2S)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-pyridin-3-yl-ethyl]-3-methyl-benzenesulfonamide

Systemtic Name: 4-methoxy-N-[(2S)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-pyridin-3-yl-ethyl]-3-methyl-benzenesulfonamide Openeye Name: 4-methoxy-N-[(2S)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(3-pyridyl)ethyl]-3-methyl-benzenesulfonamide CAS Name: 4-methoxy-N-[(2S)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2-(3-pyridinyl)ethyl]-3-methylbenzenesulfonamide IUPAC Name: 4-methoxy-N-[(2S)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-pyridin-3-ylethyl]-3-methylbenzenesulfonamide Traditional Name: 4-methoxy-N-[(2S)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2-(3-pyridyl)ethyl]-3-methyl-benzenesulfonamide Formula: C26H33N4O4S+ MolecularWeight: 497.62962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC(C2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC[C@H](C2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4OC)OC

InChI

InChI=1S/C26H32N4O4S/c1-20-17-22(10-11-25(20)33-2)35(31,32)28-19-24(21-7-6-12-27-18-21)30-15-13-29(14-16-30)23-8-4-5-9-26(23)34-3/h4-12,17-18,24,28H,13-16,19H2,1-3H3/p+1/t24-/m1/s1