2-[2-(4-chlorophenyl)-6-nitro-benzimidazol-1-yl]oxypropanoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)-6-nitro-benzimidazol-1-yl]oxypropanoic acid Openeye Name: 2-[2-(4-chlorophenyl)-6-nitro-benzimidazol-1-yl]oxypropanoic acid CAS Name: 2-[[2-(4-chlorophenyl)-6-nitro-1-benzimidazolyl]oxy]propanoic acid IUPAC Name: 2-[2-(4-chlorophenyl)-6-nitrobenzimidazol-1-yl]oxypropanoic acid Traditional Name: 2-[2-(4-chlorophenyl)-6-nitro-benzimidazol-1-yl]oxypropionic acid Formula: C16H12ClN3O5 MolecularWeight: 361.73658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)ON1C2=C(C=CC(=C2)[N+](=O)[O-])N=C1C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)O)ON1C2=C(C=CC(=C2)[N+](=O)[O-])N=C1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3O5/c1-9(16(21)22)25-19-14-8-12(20(23)24)6-7-13(14)18-15(19)10-2-4-11(17)5-3-10/h2-9H,1H3,(H,21,22)