5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-triazole-4-carboxamide CAS Name: 5-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyltriazole-4-carboxamide Traditional Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-2-phenyl-triazole-4-carboxamide Formula: C17H24N5O2+ MolecularWeight: 330.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NCCC[NH+]2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)NCCC[NH+]2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H23N5O2/c1-14-16(20-22(19-14)15-6-3-2-4-7-15)17(23)18-8-5-9-21-10-12-24-13-11-21/h2-4,6-7H,5,8-13H2,1H3,(H,18,23)/p+1