2-(2,5-dimethylphenyl)-5,7-dimethyl-3H-4,1,2-benzoxadiazin-2-ium

Systemtic Name: 2-(2,5-dimethylphenyl)-5,7-dimethyl-3H-4,1,2-benzoxadiazin-2-ium Openeye Name: 2-(2,5-dimethylphenyl)-5,7-dimethyl-3H-4,1,2-benzoxadiazin-2-ium CAS Name: 2-(2,5-dimethylphenyl)-5,7-dimethyl-3H-4,1,2-benzoxadiazin-2-ium IUPAC Name: 2-(2,5-dimethylphenyl)-5,7-dimethyl-3H-4,1,2-benzoxadiazin-2-ium Traditional Name: 2-(2,5-dimethylphenyl)-5,7-dimethyl-3H-4,1,2-benzoxadiazin-2-ium Formula: C17H19N2O+ MolecularWeight: 267.34556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)[N+]2=NC3=CC(=CC(=C3OC2)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)[N+]2=NC3=CC(=CC(=C3OC2)C)C

InChI

InChI=1S/C17H19N2O/c1-11-5-6-13(3)16(9-11)19-10-20-17-14(4)7-12(2)8-15(17)18-19/h5-9H,10H2,1-4H3/q+1