2-(2-ethyl-6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-3-ylmethyl)ethanamide

Systemtic Name: 2-(2-ethyl-6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-3-ylmethyl)ethanamide Openeye Name: 2-(2-ethyl-6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-3-ylmethyl)acetamide CAS Name: 2-(2-ethyl-6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(3-pyridin-1-iumylmethyl)acetamide IUPAC Name: 2-(2-ethyl-6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-3-ylmethyl)acetamide Traditional Name: 2-(2-ethyl-3-keto-6-methyl-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-3-ylmethyl)acetamide Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(=O)NCC3=C[NH+]=CC=C3

Isomeric SMILES

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(=O)NCC3=C[NH+]=CC=C3

InChI

InChI=1S/C19H21N3O3/c1-3-16-19(24)22(15-9-13(2)6-7-17(15)25-16)12-18(23)21-11-14-5-4-8-20-10-14/h4-10,16H,3,11-12H2,1-2H3,(H,21,23)/p+1