4-nitro-2-[(2,3,4,5-tetramethoxyphenyl)amino]benzoic acid

Systemtic Name: 4-nitro-2-[(2,3,4,5-tetramethoxyphenyl)amino]benzoic acid Openeye Name: 4-nitro-2-(2,3,4,5-tetramethoxyanilino)benzoic acid CAS Name: 4-nitro-2-(2,3,4,5-tetramethoxyanilino)benzoic acid IUPAC Name: 4-nitro-2-(2,3,4,5-tetramethoxyanilino)benzoic acid Traditional Name: 4-nitro-2-(2,3,4,5-tetramethoxyanilino)benzoic acid Formula: C17H18N2O8 MolecularWeight: 378.33342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)O)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)O)OC)OC)OC

InChI

InChI=1S/C17H18N2O8/c1-24-13-8-12(14(25-2)16(27-4)15(13)26-3)18-11-7-9(19(22)23)5-6-10(11)17(20)21/h5-8,18H,1-4H3,(H,20,21)