ethyl 4-methyl-3-oxidanylidene-2-phenyl-1,2,4-benzotriazin-4-ium-7-carboxylate

Systemtic Name: ethyl 4-methyl-3-oxidanylidene-2-phenyl-1,2,4-benzotriazin-4-ium-7-carboxylate Openeye Name: ethyl 4-methyl-3-oxo-2-phenyl-1,2,4-benzotriazin-4-ium-7-carboxylate CAS Name: 4-methyl-3-oxo-2-phenyl-1,2,4-benzotriazin-4-ium-7-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-oxo-2-phenyl-1,2,4-benzotriazin-4-ium-7-carboxylate Traditional Name: 3-keto-4-methyl-2-phenyl-1,2,4-benzotriazin-4-ium-7-carboxylic acid ethyl ester Formula: C17H16N3O3+ MolecularWeight: 310.32724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=NN(C(=O)[N+](=C2C=C1)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=NN(C(=O)[N+](=C2C=C1)C)C3=CC=CC=C3

InChI

InChI=1S/C17H16N3O3/c1-3-23-16(21)12-9-10-15-14(11-12)18-20(17(22)19(15)2)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3/q+1