4-[(2-methoxyphenyl)amino]-3-nitro-benzoic acid hydrochloride

Systemtic Name: 4-[(2-methoxyphenyl)amino]-3-nitro-benzoic acid hydrochloride Openeye Name: 4-(2-methoxyanilino)-3-nitro-benzoic acid hydrochloride CAS Name: 4-(2-methoxyanilino)-3-nitrobenzoic acid hydrochloride IUPAC Name: 4-(2-methoxyanilino)-3-nitrobenzoic acid hydrochloride Traditional Name: 3-nitro-4-(o-anisidino)benzoic acid hydrochloride Formula: C14H13ClN2O5 MolecularWeight: 324.71642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-].Cl

Isomeric SMILES

COC1=CC=CC=C1NC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H12N2O5.ClH/c1-21-13-5-3-2-4-11(13)15-10-7-6-9(14(17)18)8-12(10)16(19)20;/h2-8,15H,1H3,(H,17,18);1H