5-methoxy-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-methoxy-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-methoxy-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-methoxy-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-methoxy-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-methoxy-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C22H33N2O4+ MolecularWeight: 389.50842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)NCC3(CCCCC3)[NH+]4CCCCC4

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)NCC3(CCCCC3)[NH+]4CCCCC4

InChI

InChI=1S/C22H32N2O4/c1-26-18-14-17(15-19-20(18)28-13-12-27-19)21(25)23-16-22(8-4-2-5-9-22)24-10-6-3-7-11-24/h14-15H,2-13,16H2,1H3,(H,23,25)/p+1