(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl-[(1-pyridin-2-ylpyrrol-2-yl)methyl]azanium

Systemtic Name: (2-morpholin-4-ylpyridin-1-ium-3-yl)methyl-[(1-pyridin-2-ylpyrrol-2-yl)methyl]azanium Openeye Name: (2-morpholinopyridin-1-ium-3-yl)methyl-[[1-(2-pyridyl)pyrrol-2-yl]methyl]ammonium CAS Name: [2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (2-morpholin-4-ylpyridin-1-ium-3-yl)methyl-[(1-pyridin-2-ylpyrrol-2-yl)methyl]azanium Traditional Name: (2-morpholinopyridin-1-ium-3-yl)methyl-[[1-(2-pyridyl)pyrrol-2-yl]methyl]ammonium Formula: C20H25N5O+2 MolecularWeight: 351.4454

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=[NH+]2)C[NH2+]CC3=CC=CN3C4=CC=CC=N4

Isomeric SMILES

C1COCCN1C2=C(C=CC=[NH+]2)C[NH2+]CC3=CC=CN3C4=CC=CC=N4

InChI

InChI=1S/C20H23N5O/c1-2-8-22-19(7-1)25-10-4-6-18(25)16-21-15-17-5-3-9-23-20(17)24-11-13-26-14-12-24/h1-10,21H,11-16H2/p+2