2-[[3,4-dimethyl-2,5-bis(oxidanylidene)pyrazol-2-ium-1-yl]amino]benzoate

Systemtic Name: 2-[[3,4-dimethyl-2,5-bis(oxidanylidene)pyrazol-2-ium-1-yl]amino]benzoate Openeye Name: 2-[(3,4-dimethyl-2,5-dioxo-pyrazol-2-ium-1-yl)amino]benzoate CAS Name: 2-[(3,4-dimethyl-2,5-dioxo-1-pyrazol-2-iumyl)amino]benzoate IUPAC Name: 2-[(3,4-dimethyl-2,5-dioxopyrazol-2-ium-1-yl)amino]benzoate Traditional Name: 2-[(2,5-diketo-3,4-dimethyl-3-pyrazolin-2-ium-1-yl)amino]benzoate Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=O)N(C1=O)NC2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

CC1=C([N+](=O)N(C1=O)NC2=CC=CC=C2C(=O)[O-])C

InChI

InChI=1S/C12H11N3O4/c1-7-8(2)15(19)14(11(7)16)13-10-6-4-3-5-9(10)12(17)18/h3-6,13H,1-2H3