1-morpholin-4-yl-3-[(3R)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-3-[(3R)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]propan-1-one Openeye Name: 1-morpholino-3-[(3R)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]propan-1-one CAS Name: 1-(4-morpholinyl)-3-[(3R)-1-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-3-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-morpholin-4-yl-3-[(3R)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]propan-1-one Traditional Name: 1-morpholino-3-[(3R)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]propan-1-one Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CN2C3=CN=CC=C3)CCC(=O)N4CCOCC4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CN2C3=CN=CC=C3)CCC(=O)N4CCOCC4

InChI

InChI=1S/C22H30N4O2/c27-22(25-12-14-28-15-13-25)8-7-19-4-2-10-24(17-19)18-21-6-3-11-26(21)20-5-1-9-23-16-20/h1,3,5-6,9,11,16,19H,2,4,7-8,10,12-15,17-18H2/p+1/t19-/m1/s1