4-[(5-phenyl-1,2,4-triazol-1-yl)methyl]morpholin-4-ium

Systemtic Name: 4-[(5-phenyl-1,2,4-triazol-1-yl)methyl]morpholin-4-ium Openeye Name: 4-[(5-phenyl-1,2,4-triazol-1-yl)methyl]morpholin-4-ium CAS Name: 4-[(5-phenyl-1,2,4-triazol-1-yl)methyl]morpholin-4-ium IUPAC Name: 4-[(5-phenyl-1,2,4-triazol-1-yl)methyl]morpholin-4-ium Traditional Name: 4-[(5-phenyl-1,2,4-triazol-1-yl)methyl]morpholin-4-ium Formula: C13H17N4O+ MolecularWeight: 245.30028

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C(=NC=N2)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CN2C(=NC=N2)C3=CC=CC=C3

InChI

InChI=1S/C13H16N4O/c1-2-4-12(5-3-1)13-14-10-15-17(13)11-16-6-8-18-9-7-16/h1-5,10H,6-9,11H2/p+1