N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide Openeye Name: N-[(1R)-1-[1-[(E)-cinnamyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-furan-2-carboxamide CAS Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(E)-3-phenylprop-2-enyl]-4-piperidin-1-iumyl]ethyl]-2-furancarboxamide IUPAC Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide Traditional Name: N-[(1R)-1-[1-[(E)-cinnamyl]piperidin-1-ium-4-yl]-2-phenyl-ethyl]-N-cyclopropyl-2-furamide Formula: C30H35N2O2+ MolecularWeight: 455.6111

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC=CC4=CC=CC=C4)C(=O)C5=CC=CO5

Isomeric SMILES

C1CC1N([C@H](CC2=CC=CC=C2)C3CC[NH+](CC3)C/C=C/C4=CC=CC=C4)C(=O)C5=CC=CO5

InChI

InChI=1S/C30H34N2O2/c33-30(29-14-8-22-34-29)32(27-15-16-27)28(23-25-11-5-2-6-12-25)26-17-20-31(21-18-26)19-7-13-24-9-3-1-4-10-24/h1-14,22,26-28H,15-21,23H2/p+1/b13-7+/t28-/m1/s1