N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-1-(2-morpholin-4-ium-4-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-1-(2-morpholin-4-ium-4-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-1-(2-morpholin-4-ium-4-ylethyl)triazole-4-carboxamide CAS Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-1-[2-(4-morpholin-4-iumyl)ethyl]-4-triazolecarboxamide IUPAC Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-1-(2-morpholin-4-ium-4-ylethyl)triazole-4-carboxamide Traditional Name: N-(benzofurazan-5-ylmethyl)-N-methyl-1-(2-morpholin-4-ium-4-ylethyl)triazole-4-carboxamide Formula: C17H22N7O3+ MolecularWeight: 372.40168

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=NON=C2C=C1)C(=O)C3=CN(N=N3)CC[NH+]4CCOCC4

Isomeric SMILES

CN(CC1=CC2=NON=C2C=C1)C(=O)C3=CN(N=N3)CC[NH+]4CCOCC4

InChI

InChI=1S/C17H21N7O3/c1-22(11-13-2-3-14-15(10-13)20-27-19-14)17(25)16-12-24(21-18-16)5-4-23-6-8-26-9-7-23/h2-3,10,12H,4-9,11H2,1H3/p+1