4-(4-fluorophenyl)-1-morpholin-4-yl-5-pyridin-4-yl-1,2,3-triazol-1-ium-1-carbaldehyde

Systemtic Name: 4-(4-fluorophenyl)-1-morpholin-4-yl-5-pyridin-4-yl-1,2,3-triazol-1-ium-1-carbaldehyde Openeye Name: 4-(4-fluorophenyl)-1-morpholino-5-(4-pyridyl)triazol-1-ium-1-carbaldehyde CAS Name: 4-(4-fluorophenyl)-1-(4-morpholinyl)-5-pyridin-4-yl-1-triazol-1-iumcarboxaldehyde IUPAC Name: 4-(4-fluorophenyl)-1-morpholin-4-yl-5-pyridin-4-yltriazol-1-ium-1-carbaldehyde Traditional Name: 4-(4-fluorophenyl)-1-morpholino-5-(4-pyridyl)triazol-1-ium-1-carbaldehyde Formula: C18H17FN5O2+ MolecularWeight: 354.358283

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1[N+]2(C(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=NC=C4)C=O

Isomeric SMILES

C1COCCN1[N+]2(C(=C(N=N2)C3=CC=C(C=C3)F)C4=CC=NC=C4)C=O

InChI

InChI=1S/C18H17FN5O2/c19-16-3-1-14(2-4-16)17-18(15-5-7-20-8-6-15)24(13-25,22-21-17)23-9-11-26-12-10-23/h1-8,13H,9-12H2/q+1