1-[2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-2-yl)-1,3-benzoxazin-6-yl]ethanone

Systemtic Name: 1-[2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-2-yl)-1,3-benzoxazin-6-yl]ethanone Openeye Name: 1-[2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-1,3-benzoxazin-6-yl]ethanone CAS Name: 1-[2,2-dimethyl-4-(1-oxido-2-pyridin-1-iumyl)-1,3-benzoxazin-6-yl]ethanone IUPAC Name: 1-[2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-1,3-benzoxazin-6-yl]ethanone Traditional Name: 1-[2,2-dimethyl-4-(1-oxidopyridin-1-ium-2-yl)-1,3-benzoxazin-6-yl]ethanone Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(N=C2C3=CC=CC=[N+]3[O-])(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(N=C2C3=CC=CC=[N+]3[O-])(C)C

InChI

InChI=1S/C17H16N2O3/c1-11(20)12-7-8-15-13(10-12)16(18-17(2,3)22-15)14-6-4-5-9-19(14)21/h4-10H,1-3H3