N-cyclopropyl-N-[(1S)-1-[1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1S)-1-[1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide Openeye Name: N-cyclopropyl-N-[(1S)-1-[1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide CAS Name: N-cyclopropyl-N-[(1S)-1-[1-[(4-hydroxyphenyl)methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-2-pyridinecarboxamide IUPAC Name: N-cyclopropyl-N-[(1S)-1-[1-[(4-hydroxyphenyl)methyl]piperidin-1-ium-4-yl]-2-phenylethyl]pyridine-2-carboxamide Traditional Name: N-cyclopropyl-N-[(1S)-1-[1-(4-hydroxybenzyl)piperidin-1-ium-4-yl]-2-phenyl-ethyl]picolinamide Formula: C29H34N3O2+ MolecularWeight: 456.59916

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC=C(C=C4)O)C(=O)C5=CC=CC=N5

Isomeric SMILES

C1CC1N([C@@H](CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC=C(C=C4)O)C(=O)C5=CC=CC=N5

InChI

InChI=1S/C29H33N3O2/c33-26-13-9-23(10-14-26)21-31-18-15-24(16-19-31)28(20-22-6-2-1-3-7-22)32(25-11-12-25)29(34)27-8-4-5-17-30-27/h1-10,13-14,17,24-25,28,33H,11-12,15-16,18-21H2/p+1/t28-/m0/s1