(6,6-dimethyl-2-oxidanidyl-4,5-dihydro-1,2-oxazin-2-ium-4-yl) benzoate

Systemtic Name: (6,6-dimethyl-2-oxidanidyl-4,5-dihydro-1,2-oxazin-2-ium-4-yl) benzoate Openeye Name: (6,6-dimethyl-2-oxido-4,5-dihydrooxazin-2-ium-4-yl) benzoate CAS Name: benzoic acid (6,6-dimethyl-2-oxido-4,5-dihydrooxazin-2-ium-4-yl) ester IUPAC Name: (6,6-dimethyl-2-oxido-4,5-dihydrooxazin-2-ium-4-yl) benzoate Traditional Name: benzoic acid (6,6-dimethyl-2-oxido-4,5-dihydrooxazin-2-ium-4-yl) ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C=[N+](O1)[O-])OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(C=[N+](O1)[O-])OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C13H15NO4/c1-13(2)8-11(9-14(16)18-13)17-12(15)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3