imidazo[1,2-b]pyridazin-2-yl 2-[[4-(diphenylmethyl)oxypiperidin-1-yl]methyl]-2-methyl-hexanoate

Systemtic Name: imidazo[1,2-b]pyridazin-2-yl 2-[[4-(diphenylmethyl)oxypiperidin-1-yl]methyl]-2-methyl-hexanoate Openeye Name: imidazo[1,2-b]pyridazin-2-yl 2-[(4-benzhydryloxy-1-piperidyl)methyl]-2-methyl-hexanoate CAS Name: 2-[[4-(diphenylmethyl)oxy-1-piperidinyl]methyl]-2-methylhexanoic acid 2-imidazo[1,2-b]pyridazinyl ester IUPAC Name: imidazo[1,2-b]pyridazin-2-yl 2-[(4-benzhydryloxypiperidin-1-yl)methyl]-2-methylhexanoate Traditional Name: 2-[(4-benzhydryloxypiperidino)methyl]-2-methyl-hexanoic acid imidazo[1,2-b]pyridazin-2-yl ester Formula: C32H38N4O3 MolecularWeight: 526.66912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC4=CN5C(=N4)C=CC=N5

Isomeric SMILES

CCCCC(C)(CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC4=CN5C(=N4)C=CC=N5

InChI

InChI=1S/C32H38N4O3/c1-3-4-19-32(2,31(37)39-29-23-36-28(34-29)16-11-20-33-36)24-35-21-17-27(18-22-35)38-30(25-12-7-5-8-13-25)26-14-9-6-10-15-26/h5-16,20,23,27,30H,3-4,17-19,21-22,24H2,1-2H3