1-(2-morpholin-4-ium-4-ylethyl)-N-[(4-morpholin-4-ylphenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(4-morpholin-4-ylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(4-morpholinophenyl)methyl]triazole-4-carboxamide CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-N-[[4-(4-morpholinyl)phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-[(4-morpholin-4-ylphenyl)methyl]triazole-4-carboxamide Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-N-(4-morpholinobenzyl)triazole-4-carboxamide Formula: C20H29N6O3+ MolecularWeight: 401.48266

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C=C(N=N2)C(=O)NCC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

C1COCC[NH+]1CCN2C=C(N=N2)C(=O)NCC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C20H28N6O3/c27-20(19-16-26(23-22-19)6-5-24-7-11-28-12-8-24)21-15-17-1-3-18(4-2-17)25-9-13-29-14-10-25/h1-4,16H,5-15H2,(H,21,27)/p+1