2-[5-chloranyl-3-[(2-chloranyl-5-nitro-phenyl)methyl]-2-phenyl-imidazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-3-[(2-chloranyl-5-nitro-phenyl)methyl]-2-phenyl-imidazol-4-yl]ethanoic acid Openeye Name: 2-[5-chloro-3-[(2-chloro-5-nitro-phenyl)methyl]-2-phenyl-imidazol-4-yl]acetic acid CAS Name: 2-[5-chloro-3-[(2-chloro-5-nitrophenyl)methyl]-2-phenyl-4-imidazolyl]acetic acid IUPAC Name: 2-[5-chloro-3-[(2-chloro-5-nitrophenyl)methyl]-2-phenylimidazol-4-yl]acetic acid Traditional Name: 2-[5-chloro-3-(2-chloro-5-nitro-benzyl)-2-phenyl-imidazol-4-yl]acetic acid Formula: C18H13Cl2N3O4 MolecularWeight: 406.21952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(N2CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)CC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(N2CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)CC(=O)O)Cl

InChI

InChI=1S/C18H13Cl2N3O4/c19-14-7-6-13(23(26)27)8-12(14)10-22-15(9-16(24)25)17(20)21-18(22)11-4-2-1-3-5-11/h1-8H,9-10H2,(H,24,25)