4-[2-(4-nitrophenyl)-4H-imidazo[4,5-b]indol-3-yl]benzoic acid

Systemtic Name: 4-[2-(4-nitrophenyl)-4H-imidazo[4,5-b]indol-3-yl]benzoic acid Openeye Name: 4-[2-(4-nitrophenyl)-4H-imidazo[4,5-b]indol-3-yl]benzoic acid CAS Name: 4-[2-(4-nitrophenyl)-4H-imidazo[4,5-b]indol-3-yl]benzoic acid IUPAC Name: 4-[2-(4-nitrophenyl)-4H-imidazo[4,5-b]indol-3-yl]benzoic acid Traditional Name: 4-[2-(4-nitrophenyl)-4H-imidaz[4,5-b]indol-3-yl]benzoic acid Formula: C22H14N4O4 MolecularWeight: 398.37096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(N2)N(C(=N3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(N2)N(C(=N3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C22H14N4O4/c27-22(28)14-7-9-15(10-8-14)25-20(13-5-11-16(12-6-13)26(29)30)24-19-17-3-1-2-4-18(17)23-21(19)25/h1-12,23H,(H,27,28)