tert-butyl 4-[1-[5,6-bis(chloranyl)pyridazin-4-yl]piperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-[5,6-bis(chloranyl)pyridazin-4-yl]piperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(5,6-dichloropyridazin-4-yl)piperidine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(5,6-dichloro-4-pyridazinyl)-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(5,6-dichloropyridazin-4-yl)piperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(5,6-dichloropyridazin-4-yl)isonipecotoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H27Cl2N5O3 MolecularWeight: 444.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=CN=NC(=C3Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=CN=NC(=C3Cl)Cl

InChI

InChI=1S/C19H27Cl2N5O3/c1-19(2,3)29-18(28)26-10-8-25(9-11-26)17(27)13-4-6-24(7-5-13)14-12-22-23-16(21)15(14)20/h12-13H,4-11H2,1-3H3