1-[(4-ethoxyphenyl)methyl]-N-(furan-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]-N-(furan-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(4-ethoxyphenyl)methyl]-N-(2-furylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-ethoxyphenyl)methyl]-N-(2-furanylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(4-ethoxyphenyl)methyl]-N-(furan-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(4-ethoxybenzyl)-N-(2-furfuryl)piperidin-1-ium-4-carboxamide Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H26N2O3/c1-2-24-18-7-5-16(6-8-18)15-22-11-9-17(10-12-22)20(23)21-14-19-4-3-13-25-19/h3-8,13,17H,2,9-12,14-15H2,1H3,(H,21,23)/p+1