2-[2-[(4-chlorophenyl)iminomethyl]-4-nitro-phenoxy]carbonyl-3-nitro-benzoic acid

Systemtic Name: 2-[2-[(4-chlorophenyl)iminomethyl]-4-nitro-phenoxy]carbonyl-3-nitro-benzoic acid Openeye Name: 2-[2-[(4-chlorophenyl)iminomethyl]-4-nitro-phenoxy]carbonyl-3-nitro-benzoic acid CAS Name: 2-[[2-[(4-chlorophenyl)iminomethyl]-4-nitrophenoxy]-oxomethyl]-3-nitrobenzoic acid IUPAC Name: 2-[2-[(4-chlorophenyl)iminomethyl]-4-nitrophenoxy]carbonyl-3-nitrobenzoic acid Traditional Name: 2-[2-[(4-chlorophenyl)iminomethyl]-4-nitro-phenoxy]carbonyl-3-nitro-benzoic acid Formula: C21H12ClN3O8 MolecularWeight: 469.78828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C=NC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C=NC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H12ClN3O8/c22-13-4-6-14(7-5-13)23-11-12-10-15(24(29)30)8-9-18(12)33-21(28)19-16(20(26)27)2-1-3-17(19)25(31)32/h1-11H,(H,26,27)