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

Systemtic Name: methyl 6-[3-(cyclohexylmethyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate Openeye Name: methyl 6-[3-(cyclohexylmethyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoate CAS Name: 6-[[3-(cyclohexylmethyl)-2-phenyl-5-benzimidazolyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(cyclohexylmethyl)-2-phenylbenzimidazol-5-yl]oxyhexanoate Traditional Name: 6-[3-(cyclohexylmethyl)-2-phenyl-benzimidazol-5-yl]oxyhexanoic acid methyl ester Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCOC1=CC2=C(C=C1)N=C(N2CC3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCCCCOC1=CC2=C(C=C1)N=C(N2CC3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H34N2O3/c1-31-26(30)15-9-4-10-18-32-23-16-17-24-25(19-23)29(20-21-11-5-2-6-12-21)27(28-24)22-13-7-3-8-14-22/h3,7-8,13-14,16-17,19,21H,2,4-6,9-12,15,18,20H2,1H3