8-[[4-(diphenylmethyl)oxypiperidin-1-yl]-propyl-amino]-2-methyl-imidazo[1,2-b]pyridazine-3-carboxylic acid

Systemtic Name: 8-[[4-(diphenylmethyl)oxypiperidin-1-yl]-propyl-amino]-2-methyl-imidazo[1,2-b]pyridazine-3-carboxylic acid Openeye Name: 8-[(4-benzhydryloxy-1-piperidyl)-propyl-amino]-2-methyl-imidazo[1,2-b]pyridazine-3-carboxylic acid CAS Name: 8-[[4-(diphenylmethyl)oxy-1-piperidinyl]-propylamino]-2-methyl-3-imidazo[1,2-b]pyridazinecarboxylic acid IUPAC Name: 8-[(4-benzhydryloxypiperidin-1-yl)-propylamino]-2-methylimidazo[1,2-b]pyridazine-3-carboxylic acid Traditional Name: 8-[(4-benzhydryloxypiperidino)-propyl-amino]-2-methyl-imidazo[1,2-b]pyridazine-3-carboxylic acid Formula: C29H33N5O3 MolecularWeight: 499.60402

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=NN2C1=NC(=C2C(=O)O)C)N3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCN(C1=CC=NN2C1=NC(=C2C(=O)O)C)N3CCC(CC3)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H33N5O3/c1-3-18-33(25-14-17-30-34-26(29(35)36)21(2)31-28(25)34)32-19-15-24(16-20-32)37-27(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-14,17,24,27H,3,15-16,18-20H2,1-2H3,(H,35,36)