1-[(4-ethoxyphenyl)methyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(4-ethoxyphenyl)methyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[(4-ethoxyphenyl)methyl]-N-(2-hydroxyethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(4-ethoxyphenyl)methyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[(4-ethoxyphenyl)methyl]-N-(2-hydroxyethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-(4-ethoxybenzyl)-N-(2-hydroxyethyl)piperidin-1-ium-4-carboxamide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N(CCO)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N(CCO)CC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3/c1-2-29-23-10-8-21(9-11-23)18-25-14-12-22(13-15-25)24(28)26(16-17-27)19-20-6-4-3-5-7-20/h3-11,22,27H,2,12-19H2,1H3/p+1