5-nitro-2-[(2,4,6-trimethylphenyl)amino]benzoic acid

Systemtic Name: 5-nitro-2-[(2,4,6-trimethylphenyl)amino]benzoic acid Openeye Name: 5-nitro-2-(2,4,6-trimethylanilino)benzoic acid CAS Name: 5-nitro-2-(2,4,6-trimethylanilino)benzoic acid IUPAC Name: 5-nitro-2-(2,4,6-trimethylanilino)benzoic acid Traditional Name: 2-mesidino-5-nitro-benzoic acid Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O4/c1-9-6-10(2)15(11(3)7-9)17-14-5-4-12(18(21)22)8-13(14)16(19)20/h4-8,17H,1-3H3,(H,19,20)