benzimidazol-1-yl 2-(2-cyanophenyl)-2-methyl-octanoate

Systemtic Name: benzimidazol-1-yl 2-(2-cyanophenyl)-2-methyl-octanoate Openeye Name: benzimidazol-1-yl 2-(2-cyanophenyl)-2-methyl-octanoate CAS Name: 2-(2-cyanophenyl)-2-methyloctanoic acid 1-benzimidazolyl ester IUPAC Name: benzimidazol-1-yl 2-(2-cyanophenyl)-2-methyloctanoate Traditional Name: 2-(2-cyanophenyl)-2-methyl-caprylic acid benzimidazol-1-yl ester Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C1=CC=CC=C1C#N)C(=O)ON2C=NC3=CC=CC=C32

Isomeric SMILES

CCCCCCC(C)(C1=CC=CC=C1C#N)C(=O)ON2C=NC3=CC=CC=C32

InChI

InChI=1S/C23H25N3O2/c1-3-4-5-10-15-23(2,19-12-7-6-11-18(19)16-24)22(27)28-26-17-25-20-13-8-9-14-21(20)26/h6-9,11-14,17H,3-5,10,15H2,1-2H3