7-isocyano-5-methyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one

Systemtic Name: 7-isocyano-5-methyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one Openeye Name: 7-isocyano-5-methyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one CAS Name: 7-isocyano-5-methyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one IUPAC Name: 7-isocyano-5-methyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one Traditional Name: 7-isocyano-5-methyl-2-phenyl-4,1,2-benzoxadiazin-2-ium-3-one Formula: C15H10N3O2+ MolecularWeight: 264.2588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1OC(=O)[N+](=N2)C3=CC=CC=C3)[N+]#[C-]

Isomeric SMILES

CC1=CC(=CC2=C1OC(=O)[N+](=N2)C3=CC=CC=C3)[N+]#[C-]

InChI

InChI=1S/C15H10N3O2/c1-10-8-11(16-2)9-13-14(10)20-15(19)18(17-13)12-6-4-3-5-7-12/h3-9H,1H3/q+1