N-ethyl-1-[(2-hydroxyphenyl)methyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-ethyl-1-[(2-hydroxyphenyl)methyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-N-ethyl-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-ethyl-1-[(2-hydroxyphenyl)methyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-N-ethyl-1-[(2-hydroxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-N-ethyl-1-salicyl-piperidin-1-ium-4-carboxamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2CC[NH+](CC2)CC3=CC=CC=C3O

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2CC[NH+](CC2)CC3=CC=CC=C3O

InChI

InChI=1S/C22H28N2O2/c1-2-24(16-18-8-4-3-5-9-18)22(26)19-12-14-23(15-13-19)17-20-10-6-7-11-21(20)25/h3-11,19,25H,2,12-17H2,1H3/p+1