3-[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1H-benzimidazol-2-yl]hexanoic acid

Systemtic Name: 3-[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1H-benzimidazol-2-yl]hexanoic acid Openeye Name: 3-[6-[(4-benzhydrylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]hexanoic acid CAS Name: 3-[6-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1H-benzimidazol-2-yl]hexanoic acid IUPAC Name: 3-[6-[(4-benzhydrylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]hexanoic acid Traditional Name: 3-[6-[(4-benzhydrylpiperazino)methyl]-1H-benzimidazol-2-yl]hexanoic acid Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)O)C1=NC2=C(N1)C=C(C=C2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC(CC(=O)O)C1=NC2=C(N1)C=C(C=C2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H36N4O2/c1-2-9-26(21-29(36)37)31-32-27-15-14-23(20-28(27)33-31)22-34-16-18-35(19-17-34)30(24-10-5-3-6-11-24)25-12-7-4-8-13-25/h3-8,10-15,20,26,30H,2,9,16-19,21-22H2,1H3,(H,32,33)(H,36,37)