octyl 2-[2-[5-[2-(6-octoxycarbonyl-1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-3H-benzimidazole-5-carboxylate

Systemtic Name: octyl 2-[2-[5-[2-(6-octoxycarbonyl-1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-3H-benzimidazole-5-carboxylate Openeye Name: octyl 2-[2-[5-[2-(6-octoxycarbonyl-1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-3H-benzimidazole-5-carboxylate CAS Name: 2-[2-[5-[2-[6-[octoxy(oxo)methyl]-1H-benzimidazol-2-yl]phenoxy]pentoxy]phenyl]-3H-benzimidazole-5-carboxylic acid octyl ester IUPAC Name: octyl 2-[2-[5-[2-(6-octoxycarbonyl-1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-3H-benzimidazole-5-carboxylate Traditional Name: 2-[2-[5-[2-(6-octoxycarbonyl-1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-3H-benzimidazole-5-carboxylic acid octyl ester Formula: C49H60N4O6 MolecularWeight: 801.0239

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=CC=C3OCCCCCOC4=CC=CC=C4C5=NC6=C(N5)C=C(C=C6)C(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=CC=C3OCCCCCOC4=CC=CC=C4C5=NC6=C(N5)C=C(C=C6)C(=O)OCCCCCCCC

InChI

InChI=1S/C49H60N4O6/c1-3-5-7-9-11-18-32-58-48(54)36-26-28-40-42(34-36)52-46(50-40)38-22-14-16-24-44(38)56-30-20-13-21-31-57-45-25-17-15-23-39(45)47-51-41-29-27-37(35-43(41)53-47)49(55)59-33-19-12-10-8-6-4-2/h14-17,22-29,34-35H,3-13,18-21,30-33H2,1-2H3,(H,50,52)(H,51,53)