N-(3-morpholin-4-ylpropyl)-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(3-morpholinopropyl)-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide CAS Name: N-[3-(4-morpholinyl)propyl]-1-[2-(1-piperidin-1-iumyl)ethyl]-4-triazolecarboxamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Traditional Name: N-(3-morpholinopropyl)-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Formula: C17H31N6O2+ MolecularWeight: 351.46704

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C=C(N=N2)C(=O)NCCCN3CCOCC3

Isomeric SMILES

C1CC[NH+](CC1)CCN2C=C(N=N2)C(=O)NCCCN3CCOCC3

InChI

InChI=1S/C17H30N6O2/c24-17(18-5-4-8-22-11-13-25-14-12-22)16-15-23(20-19-16)10-9-21-6-2-1-3-7-21/h15H,1-14H2,(H,18,24)/p+1