6-(5-bromanyl-1-oxidanidyl-pyridin-1-ium-3-yl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-(5-bromanyl-1-oxidanidyl-pyridin-1-ium-3-yl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-(5-bromo-1-oxido-pyridin-1-ium-3-yl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-(5-bromo-1-oxido-3-pyridin-1-iumyl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-(5-bromo-1-oxidopyridin-1-ium-3-yl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-(5-bromo-1-oxido-pyridin-1-ium-3-yl)-4,4-dimethyl-1H-3,1-benzoxazin-2-one Formula: C15H13BrN2O3 MolecularWeight: 349.17932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=C[N+](=C3)[O-])Br)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=C[N+](=C3)[O-])Br)NC(=O)O1)C

InChI

InChI=1S/C15H13BrN2O3/c1-15(2)12-6-9(3-4-13(12)17-14(19)21-15)10-5-11(16)8-18(20)7-10/h3-8H,1-2H3,(H,17,19)