2-chloranyl-6-[(4-methoxyphenyl)amino]-3,5-dinitro-benzoic acid

Systemtic Name: 2-chloranyl-6-[(4-methoxyphenyl)amino]-3,5-dinitro-benzoic acid Openeye Name: 2-chloro-6-(4-methoxyanilino)-3,5-dinitro-benzoic acid CAS Name: 2-chloro-6-(4-methoxyanilino)-3,5-dinitrobenzoic acid IUPAC Name: 2-chloro-6-(4-methoxyanilino)-3,5-dinitrobenzoic acid Traditional Name: 2-chloro-3,5-dinitro-6-(p-anisidino)benzoic acid Formula: C14H10ClN3O7 MolecularWeight: 367.6981

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClN3O7/c1-25-8-4-2-7(3-5-8)16-13-10(18(23)24)6-9(17(21)22)12(15)11(13)14(19)20/h2-6,16H,1H3,(H,19,20)