2-[4-[[2-(4-methylpiperazin-1-yl)benzimidazol-1-yl]methyl]phenyl]cyclohexane-1-carboxylate

Systemtic Name: 2-[4-[[2-(4-methylpiperazin-1-yl)benzimidazol-1-yl]methyl]phenyl]cyclohexane-1-carboxylate Openeye Name: 2-[4-[[2-(4-methylpiperazin-1-yl)benzimidazol-1-yl]methyl]phenyl]cyclohexanecarboxylate CAS Name: 2-[4-[[2-(4-methyl-1-piperazinyl)-1-benzimidazolyl]methyl]phenyl]-1-cyclohexanecarboxylate IUPAC Name: 2-[4-[[2-(4-methylpiperazin-1-yl)benzimidazol-1-yl]methyl]phenyl]cyclohexane-1-carboxylate Traditional Name: 2-[4-[[2-(4-methylpiperazino)benzimidazol-1-yl]methyl]phenyl]cyclohexanecarboxylate Formula: C26H31N4O2- MolecularWeight: 431.54994

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C5CCCCC5C(=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)C5CCCCC5C(=O)[O-]

InChI

InChI=1S/C26H32N4O2/c1-28-14-16-29(17-15-28)26-27-23-8-4-5-9-24(23)30(26)18-19-10-12-20(13-11-19)21-6-2-3-7-22(21)25(31)32/h4-5,8-13,21-22H,2-3,6-7,14-18H2,1H3,(H,31,32)/p-1