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

Systemtic Name: 2-(2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-2-ylmethyl)ethanamide Openeye Name: 2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-2-ylmethyl)acetamide CAS Name: 2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyridin-1-iumylmethyl)acetamide IUPAC Name: 2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-2-ylmethyl)acetamide Traditional Name: 2-(2-ethyl-3-keto-1,4-benzoxazin-4-yl)-N-(pyridin-1-ium-2-ylmethyl)acetamide Formula: C18H20N3O3+ MolecularWeight: 326.3697

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CC=CC=C2O1)CC(=O)NCC3=CC=CC=[NH+]3

Isomeric SMILES

CCC1C(=O)N(C2=CC=CC=C2O1)CC(=O)NCC3=CC=CC=[NH+]3

InChI

InChI=1S/C18H19N3O3/c1-2-15-18(23)21(14-8-3-4-9-16(14)24-15)12-17(22)20-11-13-7-5-6-10-19-13/h3-10,15H,2,11-12H2,1H3,(H,20,22)/p+1