1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-(furan-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-(furan-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-(2-furylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-(2-furanylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-1-(furan-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(4,6-dimethoxy-s-triazin-2-yl)-1-(2-furfuryl)piperidin-1-ium-4-carboxamide Formula: C16H22N5O4+ MolecularWeight: 348.37698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)[N+]2(CCC(CC2)C(=O)N)CC3=CC=CO3)OC

Isomeric SMILES

COC1=NC(=NC(=N1)[N+]2(CCC(CC2)C(=O)N)CC3=CC=CO3)OC

InChI

InChI=1S/C16H21N5O4/c1-23-15-18-14(19-16(20-15)24-2)21(10-12-4-3-9-25-12)7-5-11(6-8-21)13(17)22/h3-4,9,11H,5-8,10H2,1-2H3,(H-,17,22)/p+1