methyl 6-[3-(3,5-dimethylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate

Systemtic Name: methyl 6-[3-(3,5-dimethylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate Openeye Name: methyl 6-[3-(3,5-dimethylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate CAS Name: 6-[[3-(3,5-dimethylphenyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(3,5-dimethylphenyl)-2-phenylbenzimidazol-5-yl]oxyhexanoate Traditional Name: 6-[3-(3,5-dimethylphenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid methyl ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)OC)N=C2C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C3=C(C=CC(=C3)OCCCCCC(=O)OC)N=C2C4=CC=CC=C4)C

InChI

InChI=1S/C28H30N2O3/c1-20-16-21(2)18-23(17-20)30-26-19-24(33-15-9-5-8-12-27(31)32-3)13-14-25(26)29-28(30)22-10-6-4-7-11-22/h4,6-7,10-11,13-14,16-19H,5,8-9,12,15H2,1-3H3