6-[3-(3-nitrophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid

Systemtic Name: 6-[3-(3-nitrophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid Openeye Name: 6-[3-(3-nitrophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid CAS Name: 6-[[3-(3-nitrophenyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid IUPAC Name: 6-[3-(3-nitrophenyl)-2-phenylbenzimidazol-5-yl]oxyhexanoic acid Traditional Name: 6-[3-(3-nitrophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(N2C4=CC(=CC=C4)[N+](=O)[O-])C=C(C=C3)OCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(N2C4=CC(=CC=C4)[N+](=O)[O-])C=C(C=C3)OCCCCCC(=O)O

InChI

InChI=1S/C25H23N3O5/c29-24(30)12-5-2-6-15-33-21-13-14-22-23(17-21)27(19-10-7-11-20(16-19)28(31)32)25(26-22)18-8-3-1-4-9-18/h1,3-4,7-11,13-14,16-17H,2,5-6,12,15H2,(H,29,30)