N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide

Systemtic Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide Openeye Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide CAS Name: N-[[2-[cyclohexyl(methyl)amino]-3-pyridin-1-iumyl]methyl]-5-(methoxymethyl)-2-furancarboxamide IUPAC Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide Traditional Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)-2-furamide Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C=CC=[NH+]2)CNC(=O)C3=CC=C(O3)COC

Isomeric SMILES

CN(C1CCCCC1)C2=C(C=CC=[NH+]2)CNC(=O)C3=CC=C(O3)COC

InChI

InChI=1S/C20H27N3O3/c1-23(16-8-4-3-5-9-16)19-15(7-6-12-21-19)13-22-20(24)18-11-10-17(26-18)14-25-2/h6-7,10-12,16H,3-5,8-9,13-14H2,1-2H3,(H,22,24)/p+1