2-[(2-methyl-4-oxidanylidene-3-phenyl-1H-pyridazin-2-ium-6-yl)amino]benzoate

Systemtic Name: 2-[(2-methyl-4-oxidanylidene-3-phenyl-1H-pyridazin-2-ium-6-yl)amino]benzoate Openeye Name: 2-[(2-methyl-4-oxo-3-phenyl-1H-pyridazin-2-ium-6-yl)amino]benzoate CAS Name: 2-[(2-methyl-4-oxo-3-phenyl-1H-pyridazin-2-ium-6-yl)amino]benzoate IUPAC Name: 2-[(2-methyl-4-oxo-3-phenyl-1H-pyridazin-2-ium-6-yl)amino]benzoate Traditional Name: 2-[(4-keto-2-methyl-3-phenyl-1H-pyridazin-2-ium-6-yl)amino]benzoate Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=O)C=C(N1)NC2=CC=CC=C2C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C[N+]1=C(C(=O)C=C(N1)NC2=CC=CC=C2C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O3/c1-21-17(12-7-3-2-4-8-12)15(22)11-16(20-21)19-14-10-6-5-9-13(14)18(23)24/h2-11H,1H3,(H2-,19,20,22,23,24)