methyl 6-[3-(4-cyanophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate

Systemtic Name: methyl 6-[3-(4-cyanophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate Openeye Name: methyl 6-[3-(4-cyanophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate CAS Name: 6-[[3-(4-cyanophenyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(4-cyanophenyl)-2-phenylbenzimidazol-5-yl]oxyhexanoate Traditional Name: 6-[3-(4-cyanophenyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid methyl ester Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCOC1=CC2=C(C=C1)N=C(N2C3=CC=C(C=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCCCCOC1=CC2=C(C=C1)N=C(N2C3=CC=C(C=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O3/c1-32-26(31)10-6-3-7-17-33-23-15-16-24-25(18-23)30(22-13-11-20(19-28)12-14-22)27(29-24)21-8-4-2-5-9-21/h2,4-5,8-9,11-16,18H,3,6-7,10,17H2,1H3