2-[[3-[(2-carboxy-5-nitro-phenyl)iminomethyl]phenyl]methylideneamino]-4-nitro-benzoic acid

Systemtic Name: 2-[[3-[(2-carboxy-5-nitro-phenyl)iminomethyl]phenyl]methylideneamino]-4-nitro-benzoic acid Openeye Name: 2-[[3-[(2-carboxy-5-nitro-phenyl)iminomethyl]phenyl]methyleneamino]-4-nitro-benzoic acid CAS Name: 2-[[3-[(2-carboxy-5-nitrophenyl)iminomethyl]phenyl]methylideneamino]-4-nitrobenzoic acid IUPAC Name: 2-[[3-[(2-carboxy-5-nitrophenyl)iminomethyl]phenyl]methylideneamino]-4-nitrobenzoic acid Traditional Name: 2-[[3-[(2-carboxy-5-nitro-phenyl)iminomethyl]benzylidene]amino]-4-nitro-benzoic acid Formula: C22H14N4O8 MolecularWeight: 462.36856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)O)C=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C=NC2=C(C=CC(=C2)[N+](=O)[O-])C(=O)O)C=NC3=C(C=CC(=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C22H14N4O8/c27-21(28)17-6-4-15(25(31)32)9-19(17)23-11-13-2-1-3-14(8-13)12-24-20-10-16(26(33)34)5-7-18(20)22(29)30/h1-12H,(H,27,28)(H,29,30)