5-[(2,4-dimethylphenyl)amino]-2-nitro-benzoic acid

Systemtic Name: 5-[(2,4-dimethylphenyl)amino]-2-nitro-benzoic acid Openeye Name: 5-(2,4-dimethylanilino)-2-nitro-benzoic acid CAS Name: 5-(2,4-dimethylanilino)-2-nitrobenzoic acid IUPAC Name: 5-(2,4-dimethylanilino)-2-nitrobenzoic acid Traditional Name: 5-(2,4-dimethylanilino)-2-nitro-benzoic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C15H14N2O4/c1-9-3-5-13(10(2)7-9)16-11-4-6-14(17(20)21)12(8-11)15(18)19/h3-8,16H,1-2H3,(H,18,19)