2,3-dimethoxy-4-[4-(2-methoxyphenyl)-1-(2-oxidanylpropyl)piperazin-1-ium-1-yl]oxy-6-methyl-phenol hydrochloride

Systemtic Name: 2,3-dimethoxy-4-[4-(2-methoxyphenyl)-1-(2-oxidanylpropyl)piperazin-1-ium-1-yl]oxy-6-methyl-phenol hydrochloride Openeye Name: 4-[1-(2-hydroxypropyl)-4-(2-methoxyphenyl)piperazin-1-ium-1-yl]oxy-2,3-dimethoxy-6-methyl-phenol hydrochloride CAS Name: 4-[[1-(2-hydroxypropyl)-4-(2-methoxyphenyl)-1-piperazin-1-iumyl]oxy]-2,3-dimethoxy-6-methylphenol hydrochloride IUPAC Name: 4-[1-(2-hydroxypropyl)-4-(2-methoxyphenyl)piperazin-1-ium-1-yl]oxy-2,3-dimethoxy-6-methylphenol hydrochloride Traditional Name: 4-[1-(2-hydroxypropyl)-4-(2-methoxyphenyl)piperazin-1-ium-1-yl]oxy-2,3-dimethoxy-6-methyl-phenol hydrochloride Formula: C23H34ClN2O6+ MolecularWeight: 469.97886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1O)OC)OC)O[N+]2(CCN(CC2)C3=CC=CC=C3OC)CC(C)O.Cl

Isomeric SMILES

CC1=CC(=C(C(=C1O)OC)OC)O[N+]2(CCN(CC2)C3=CC=CC=C3OC)CC(C)O.Cl

InChI

InChI=1S/C23H32N2O6.ClH/c1-16-14-20(22(29-4)23(30-5)21(16)27)31-25(15-17(2)26)12-10-24(11-13-25)18-8-6-7-9-19(18)28-3;/h6-9,14,17,26H,10-13,15H2,1-5H3;1H/p+1