N-[(2R)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-1-methyl-4-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(2R)-2-(3-hydroxyphenyl)-2-oxidanyl-ethyl]-1-methyl-4-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: N-[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-1-methyl-4-phenyl-piperidin-1-ium-4-carboxamide CAS Name: N-[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-1-methyl-4-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-1-methyl-4-phenylpiperidin-1-ium-4-carboxamide Traditional Name: N-[(2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl]-1-methyl-4-phenyl-piperidin-1-ium-4-carboxamide Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)(C2=CC=CC=C2)C(=O)NCC(C3=CC(=CC=C3)O)O

Isomeric SMILES

C[NH+]1CCC(CC1)(C2=CC=CC=C2)C(=O)NC[C@@H](C3=CC(=CC=C3)O)O

InChI

InChI=1S/C21H26N2O3/c1-23-12-10-21(11-13-23,17-7-3-2-4-8-17)20(26)22-15-19(25)16-6-5-9-18(24)14-16/h2-9,14,19,24-25H,10-13,15H2,1H3,(H,22,26)/p+1/t19-/m0/s1