6-[4-(diphenylmethyl)piperazin-1-yl]-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-hexanoic acid

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-1-yl]-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-hexanoic acid Openeye Name: 6-(4-benzhydrylpiperazin-1-yl)-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-hexanoic acid CAS Name: 6-[4-(diphenylmethyl)-1-piperazinyl]-2-(2-imidazo[1,2-b]pyridazinyl)-2-methylhexanoic acid IUPAC Name: 6-(4-benzhydrylpiperazin-1-yl)-2-imidazo[1,2-b]pyridazin-2-yl-2-methylhexanoic acid Traditional Name: 6-(4-benzhydrylpiperazino)-2-imidazo[1,2-b]pyridazin-2-yl-2-methyl-hexanoic acid Formula: C30H35N5O2 MolecularWeight: 497.6312

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CN5C(=N4)C=CC=N5)C(=O)O

Isomeric SMILES

CC(CCCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)(C4=CN5C(=N4)C=CC=N5)C(=O)O

InChI

InChI=1S/C30H35N5O2/c1-30(29(36)37,26-23-35-27(32-26)15-10-17-31-35)16-8-9-18-33-19-21-34(22-20-33)28(24-11-4-2-5-12-24)25-13-6-3-7-14-25/h2-7,10-15,17,23,28H,8-9,16,18-22H2,1H3,(H,36,37)