8-methyl-3-pyrimidin-2-yl-1,3-benzoxazin-3-ium-2-one

Systemtic Name: 8-methyl-3-pyrimidin-2-yl-1,3-benzoxazin-3-ium-2-one Openeye Name: 8-methyl-3-pyrimidin-2-yl-1,3-benzoxazin-3-ium-2-one CAS Name: 8-methyl-3-(2-pyrimidinyl)-1,3-benzoxazin-3-ium-2-one IUPAC Name: 8-methyl-3-pyrimidin-2-yl-1,3-benzoxazin-3-ium-2-one Traditional Name: 8-methyl-3-(2-pyrimidyl)-1,3-benzoxazin-3-ium-2-one Formula: C13H10N3O2+ MolecularWeight: 240.2374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC(=O)[N+](=C2)C3=NC=CC=N3

Isomeric SMILES

CC1=CC=CC2=C1OC(=O)[N+](=C2)C3=NC=CC=N3

InChI

InChI=1S/C13H10N3O2/c1-9-4-2-5-10-8-16(13(17)18-11(9)10)12-14-6-3-7-15-12/h2-8H,1H3/q+1