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

Systemtic Name: 4-[(3,5-dimethoxyphenyl)amino]-3-nitro-benzoic acid Openeye Name: 4-(3,5-dimethoxyanilino)-3-nitro-benzoic acid CAS Name: 4-(3,5-dimethoxyanilino)-3-nitrobenzoic acid IUPAC Name: 4-(3,5-dimethoxyanilino)-3-nitrobenzoic acid Traditional Name: 4-(3,5-dimethoxyanilino)-3-nitro-benzoic acid Formula: C15H14N2O6 MolecularWeight: 318.28146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O6/c1-22-11-6-10(7-12(8-11)23-2)16-13-4-3-9(15(18)19)5-14(13)17(20)21/h3-8,16H,1-2H3,(H,18,19)