methyl 6-[2-(4-dimethylaminophenyl)-3-(3-methoxypropyl)benzimidazol-5-yl]oxyhexanoate

Systemtic Name: methyl 6-[2-(4-dimethylaminophenyl)-3-(3-methoxypropyl)benzimidazol-5-yl]oxyhexanoate Openeye Name: methyl 6-[2-(4-dimethylaminophenyl)-3-(3-methoxypropyl)benzimidazol-5-yl]oxyhexanoate CAS Name: 6-[[2-(4-dimethylaminophenyl)-3-(3-methoxypropyl)-5-benzimidazolyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[2-(4-dimethylaminophenyl)-3-(3-methoxypropyl)benzimidazol-5-yl]oxyhexanoate Traditional Name: 6-[2-(4-dimethylaminophenyl)-3-(3-methoxypropyl)benzimidazol-5-yl]oxyhexanoic acid methyl ester Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC3=C(N2CCCOC)C=C(C=C3)OCCCCCC(=O)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC3=C(N2CCCOC)C=C(C=C3)OCCCCCC(=O)OC

InChI

InChI=1S/C26H35N3O4/c1-28(2)21-12-10-20(11-13-21)26-27-23-15-14-22(19-24(23)29(26)16-8-17-31-3)33-18-7-5-6-9-25(30)32-4/h10-15,19H,5-9,16-18H2,1-4H3