2-[[4-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]piperidin-1-ium-1-yl]methyl]-4-methoxy-phenol

Systemtic Name: 2-[[4-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]piperidin-1-ium-1-yl]methyl]-4-methoxy-phenol Openeye Name: 2-[[4-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]piperidin-1-ium-1-yl]methyl]-4-methoxy-phenol CAS Name: 2-[[4-[2-(3,4-dimethoxyphenyl)-1-benzimidazolyl]-1-piperidin-1-iumyl]methyl]-4-methoxyphenol IUPAC Name: 2-[[4-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]piperidin-1-ium-1-yl]methyl]-4-methoxyphenol Traditional Name: 2-[[4-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]piperidin-1-ium-1-yl]methyl]-4-methoxy-phenol Formula: C28H32N3O4+ MolecularWeight: 474.57138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C[NH+]2CCC(CC2)N3C4=CC=CC=C4N=C3C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)O)C[NH+]2CCC(CC2)N3C4=CC=CC=C4N=C3C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C28H31N3O4/c1-33-22-9-10-25(32)20(16-22)18-30-14-12-21(13-15-30)31-24-7-5-4-6-23(24)29-28(31)19-8-11-26(34-2)27(17-19)35-3/h4-11,16-17,21,32H,12-15,18H2,1-3H3/p+1