[2-[(2-butyl-4-nitro-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[(2-butyl-4-nitro-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(2-butyl-4-nitro-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(2-butyl-4-nitro-1-benzimidazolyl)methyl]-6-phenylphenyl] ester IUPAC Name: [2-[(2-butyl-4-nitrobenzimidazol-1-yl)methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(2-butyl-4-nitro-benzimidazol-1-yl)methyl]-6-phenyl-phenyl] ester Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)C=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O5/c1-2-3-15-22-26-23-20(13-8-14-21(23)28(31)32)27(22)16-18-11-7-12-19(24(18)33-25(29)30)17-9-5-4-6-10-17/h4-14H,2-3,15-16H2,1H3,(H,29,30)