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

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C16H22N5O3+ MolecularWeight: 332.37758

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H21N5O3/c22-15(17-6-3-7-20-8-10-24-11-9-20)12-21-16(23)13-4-1-2-5-14(13)18-19-21/h1-2,4-5H,3,6-12H2,(H,17,22)/p+1