(2,5-dimethoxyphenyl)-[5-oxidanyl-4-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-yl]methanone

Systemtic Name: (2,5-dimethoxyphenyl)-[5-oxidanyl-4-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-yl]methanone Openeye Name: (2,5-dimethoxyphenyl)-[5-hydroxy-4-(piperidin-1-ium-1-ylmethyl)benzofuran-3-yl]methanone CAS Name: (2,5-dimethoxyphenyl)-[5-hydroxy-4-(1-piperidin-1-iumylmethyl)-3-benzofuranyl]methanone IUPAC Name: (2,5-dimethoxyphenyl)-[5-hydroxy-4-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-yl]methanone Traditional Name: (2,5-dimethoxyphenyl)-[5-hydroxy-4-(piperidin-1-ium-1-ylmethyl)benzofuran-3-yl]methanone Formula: C23H26NO5+ MolecularWeight: 396.45624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C2=COC3=C2C(=C(C=C3)O)C[NH+]4CCCCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)C2=COC3=C2C(=C(C=C3)O)C[NH+]4CCCCC4

InChI

InChI=1S/C23H25NO5/c1-27-15-6-8-20(28-2)16(12-15)23(26)18-14-29-21-9-7-19(25)17(22(18)21)13-24-10-4-3-5-11-24/h6-9,12,14,25H,3-5,10-11,13H2,1-2H3/p+1