5-chloranyl-2-[(4-methoxycarbonylphenyl)amino]-3-nitro-benzoic acid

Systemtic Name: 5-chloranyl-2-[(4-methoxycarbonylphenyl)amino]-3-nitro-benzoic acid Openeye Name: 5-chloro-2-(4-methoxycarbonylanilino)-3-nitro-benzoic acid CAS Name: 5-chloro-2-(4-methoxycarbonylanilino)-3-nitrobenzoic acid IUPAC Name: 5-chloro-2-(4-methoxycarbonylanilino)-3-nitrobenzoic acid Traditional Name: 2-(4-carbomethoxyanilino)-5-chloro-3-nitro-benzoic acid Formula: C15H11ClN2O6 MolecularWeight: 350.71064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=C(C=C(C=C2C(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=C(C=C(C=C2C(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H11ClN2O6/c1-24-15(21)8-2-4-10(5-3-8)17-13-11(14(19)20)6-9(16)7-12(13)18(22)23/h2-7,17H,1H3,(H,19,20)