2-[(2,3-dimethylphenyl)amino]-3-nitro-benzoic acid

Systemtic Name: 2-[(2,3-dimethylphenyl)amino]-3-nitro-benzoic acid Openeye Name: 2-(2,3-dimethylanilino)-3-nitro-benzoic acid CAS Name: 2-(2,3-dimethylanilino)-3-nitrobenzoic acid IUPAC Name: 2-(2,3-dimethylanilino)-3-nitrobenzoic acid Traditional Name: 2-(2,3-dimethylanilino)-3-nitro-benzoic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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