1-[(2-hydroxyphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-hydroxyphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-hydroxyphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-hydroxyphenyl)methyl]-N-[(1R)-1-phenylethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-hydroxyphenyl)methyl]-N-[(1R)-1-phenylethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[(1R)-1-phenylethyl]-1-salicyl-piperidin-1-ium-4-carboxamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CC[NH+](CC2)CC3=CC=CC=C3O

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2CC[NH+](CC2)CC3=CC=CC=C3O

InChI

InChI=1S/C21H26N2O2/c1-16(17-7-3-2-4-8-17)22-21(25)18-11-13-23(14-12-18)15-19-9-5-6-10-20(19)24/h2-10,16,18,24H,11-15H2,1H3,(H,22,25)/p+1/t16-/m1/s1