N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-furan-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-furan-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-furan-2-carboxamide CAS Name: N-[(1R)-1-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-piperidin-1-iumyl]-2-phenylethyl]-N-cyclopropyl-2-furancarboxamide IUPAC Name: N-[(1R)-1-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]piperidin-1-ium-4-yl]-2-phenylethyl]-N-cyclopropylfuran-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-2-furamide Formula: C28H37N2O2+ MolecularWeight: 433.60558

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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=CO5

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH+]2CCC(CC2)[C@@H](CC3=CC=CC=C3)N(C4CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C28H36N2O2/c31-28(27-12-7-19-32-27)30(25-13-14-25)26(20-22-8-3-1-4-9-22)24-15-17-29(18-16-24)21-23-10-5-2-6-11-23/h1-5,7-9,12,19,23-26H,6,10-11,13-18,20-21H2/p+1/t23-,26-/m1/s1