2-(1,2,4-benzotriazin-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-(1,2,4-benzotriazin-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-(1,2,4-benzotriazin-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-(1,2,4-benzotriazin-3-yl)-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(1,2,4-benzotriazin-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(1,2,4-benzotriazin-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C16H22N5O2+ MolecularWeight: 316.37818

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)CC2=NC3=CC=CC=C3N=N2

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)CC2=NC3=CC=CC=C3N=N2

InChI

InChI=1S/C16H21N5O2/c22-16(17-6-3-7-21-8-10-23-11-9-21)12-15-18-13-4-1-2-5-14(13)19-20-15/h1-2,4-5H,3,6-12H2,(H,17,22)/p+1