N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide Openeye Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide CAS Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-4-piperidin-1-iumyl]ethyl]-2-furancarboxamide IUPAC Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]ethyl]furan-2-carboxamide Traditional Name: N-cyclopropyl-N-[(1R)-2-phenyl-1-[1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]ethyl]-2-furamide Formula: C31H35N4O2+ MolecularWeight: 495.6352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C(CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC=CN4C5=CN=CC=C5)C(=O)C6=CC=CO6

Isomeric SMILES

C1CC1N([C@H](CC2=CC=CC=C2)C3CC[NH+](CC3)CC4=CC=CN4C5=CN=CC=C5)C(=O)C6=CC=CO6

InChI

InChI=1S/C31H34N4O2/c36-31(30-11-6-20-37-30)35(26-12-13-26)29(21-24-7-2-1-3-8-24)25-14-18-33(19-15-25)23-28-10-5-17-34(28)27-9-4-16-32-22-27/h1-11,16-17,20,22,25-26,29H,12-15,18-19,21,23H2/p+1/t29-/m1/s1