[5-[1-(cyclohexylmethyl)-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-yl]-morpholin-4-yl-methanone

Systemtic Name: [5-[1-(cyclohexylmethyl)-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-yl]-morpholin-4-yl-methanone Openeye Name: [5-[1-(cyclohexylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-yl]-morpholino-methanone CAS Name: [5-[1-(cyclohexylmethyl)-4-hydroxy-4-piperidin-1-iumyl]-2-benzofuranyl]-(4-morpholinyl)methanone IUPAC Name: [5-[1-(cyclohexylmethyl)-4-hydroxypiperidin-1-ium-4-yl]-1-benzofuran-2-yl]-morpholin-4-ylmethanone Traditional Name: [5-[1-(cyclohexylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-yl]-morpholino-methanone Formula: C25H35N2O4+ MolecularWeight: 427.5564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)N5CCOCC5)O

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)N5CCOCC5)O

InChI

InChI=1S/C25H34N2O4/c28-24(27-12-14-30-15-13-27)23-17-20-16-21(6-7-22(20)31-23)25(29)8-10-26(11-9-25)18-19-4-2-1-3-5-19/h6-7,16-17,19,29H,1-5,8-15,18H2/p+1