N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide

Systemtic Name: N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[4-(4-morpholin-4-iumylmethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)-N-[4-(morpholin-4-ium-4-ylmethyl)phenyl]acetamide Formula: C20H22N5O3+ MolecularWeight: 380.42038

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H21N5O3/c26-19(14-25-20(27)17-3-1-2-4-18(17)22-23-25)21-16-7-5-15(6-8-16)13-24-9-11-28-12-10-24/h1-8H,9-14H2,(H,21,26)/p+1