4-[(3S)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]morpholine

Systemtic Name: 4-[(3S)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]morpholine Openeye Name: 4-[(3S)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]morpholine CAS Name: 4-[(3S)-1-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]-3-piperidin-1-iumyl]morpholine IUPAC Name: 4-[(3S)-1-[(1-pyridin-3-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]morpholine Traditional Name: 4-[(3S)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]morpholine Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O/c1-4-17(14-20-7-1)23-9-3-6-19(23)16-21-8-2-5-18(15-21)22-10-12-24-13-11-22/h1,3-4,6-7,9,14,18H,2,5,8,10-13,15-16H2/p+1/t18-/m0/s1