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

Systemtic Name: (4-methoxyphenyl)-[5-oxidanyl-4-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-yl]methanone Openeye Name: [5-hydroxy-4-(piperidin-1-ium-1-ylmethyl)benzofuran-3-yl]-(4-methoxyphenyl)methanone CAS Name: [5-hydroxy-4-(1-piperidin-1-iumylmethyl)-3-benzofuranyl]-(4-methoxyphenyl)methanone IUPAC Name: [5-hydroxy-4-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-yl]-(4-methoxyphenyl)methanone Traditional Name: [5-hydroxy-4-(piperidin-1-ium-1-ylmethyl)benzofuran-3-yl]-(4-methoxyphenyl)methanone Formula: C22H24NO4+ MolecularWeight: 366.43026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO4/c1-26-16-7-5-15(6-8-16)22(25)18-14-27-20-10-9-19(24)17(21(18)20)13-23-11-3-2-4-12-23/h5-10,14,24H,2-4,11-13H2,1H3/p+1