N-(furan-2-ylmethyl)-1-[(3-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-1-[(3-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-furylmethyl)-1-[(2-hydroxy-3-methoxy-phenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-furanylmethyl)-1-[(2-hydroxy-3-methoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-[(2-hydroxy-3-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-furfuryl)-1-(2-hydroxy-3-methoxy-benzyl)piperidin-1-ium-4-carboxamide Formula: C19H25N2O4+ MolecularWeight: 345.4128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CO3

Isomeric SMILES

COC1=CC=CC(=C1O)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C19H24N2O4/c1-24-17-6-2-4-15(18(17)22)13-21-9-7-14(8-10-21)19(23)20-12-16-5-3-11-25-16/h2-6,11,14,22H,7-10,12-13H2,1H3,(H,20,23)/p+1