N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-pyridine-2-carboxamide

Systemtic Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-pyridine-2-carboxamide Openeye Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-pyridine-2-carboxamide CAS Name: N-[(1R)-1-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-N-cyclopropyl-2-pyridinecarboxamide IUPAC Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenylethyl]-N-cyclopropylpyridine-2-carboxamide Traditional Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-picolinamide Formula: C29H38N3O+ MolecularWeight: 444.63152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH+]2CCC(CC2)C(CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CC=N5

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCC(CC2)[C@@H](CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CC=N5

InChI

InChI=1S/C29H37N3O/c33-29(27-13-7-8-18-30-27)32(26-14-15-26)28(21-23-9-3-1-4-10-23)25-16-19-31(20-17-25)22-24-11-5-2-6-12-24/h1-5,7-10,13,18,24-26,28H,6,11-12,14-17,19-22H2/p+1/t24-,28-/m1/s1