3-[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1H-benzimidazol-2-yl]-5-methyl-hexanoic acid

Systemtic Name: 3-[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1H-benzimidazol-2-yl]-5-methyl-hexanoic acid Openeye Name: 3-[6-[(4-benzhydrylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-5-methyl-hexanoic acid CAS Name: 3-[6-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1H-benzimidazol-2-yl]-5-methylhexanoic acid IUPAC Name: 3-[6-[(4-benzhydrylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-5-methylhexanoic acid Traditional Name: 3-[6-[(4-benzhydrylpiperazino)methyl]-1H-benzimidazol-2-yl]-5-methyl-hexanoic acid Formula: C32H38N4O2 MolecularWeight: 510.66972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)CC(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/C32H38N4O2/c1-23(2)19-27(21-30(37)38)32-33-28-14-13-24(20-29(28)34-32)22-35-15-17-36(18-16-35)31(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-14,20,23,27,31H,15-19,21-22H2,1-2H3,(H,33,34)(H,37,38)