8-methylnonyl 2-[1-(8-methylnonoxycarbonyl)benzimidazol-2-yl]benzimidazole-1-carboxylate

Systemtic Name: 8-methylnonyl 2-[1-(8-methylnonoxycarbonyl)benzimidazol-2-yl]benzimidazole-1-carboxylate Openeye Name: 8-methylnonyl 2-[1-(8-methylnonoxycarbonyl)benzimidazol-2-yl]benzimidazole-1-carboxylate CAS Name: 2-[1-[8-methylnonoxy(oxo)methyl]-2-benzimidazolyl]-1-benzimidazolecarboxylic acid 8-methylnonyl ester IUPAC Name: 8-methylnonyl 2-[1-(8-methylnonoxycarbonyl)benzimidazol-2-yl]benzimidazole-1-carboxylate Traditional Name: 2-[1-(8-methylnonoxycarbonyl)benzimidazol-2-yl]benzimidazole-1-carboxylic acid 8-methylnonyl ester Formula: C36H50N4O4 MolecularWeight: 602.8066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCOC(=O)N1C2=CC=CC=C2N=C1C3=NC4=CC=CC=C4N3C(=O)OCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCOC(=O)N1C2=CC=CC=C2N=C1C3=NC4=CC=CC=C4N3C(=O)OCCCCCCCC(C)C

InChI

InChI=1S/C36H50N4O4/c1-27(2)19-11-7-5-9-17-25-43-35(41)39-31-23-15-13-21-29(31)37-33(39)34-38-30-22-14-16-24-32(30)40(34)36(42)44-26-18-10-6-8-12-20-28(3)4/h13-16,21-24,27-28H,5-12,17-20,25-26H2,1-4H3