tert-butyl 4-[[5-(4-cyanophenyl)-1H-pyridazin-2-yl]oxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-(4-cyanophenyl)-1H-pyridazin-2-yl]oxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-(4-cyanophenyl)-1H-pyridazin-2-yl]oxy]piperidine-1-carboxylate CAS Name: 4-[[5-(4-cyanophenyl)-1H-pyridazin-2-yl]oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-(4-cyanophenyl)-1H-pyridazin-2-yl]oxy]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-cyanophenyl)-1H-pyridazin-2-yl]oxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)ON2C=CC(=CN2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)ON2C=CC(=CN2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H26N4O3/c1-21(2,3)27-20(26)24-11-9-19(10-12-24)28-25-13-8-18(15-23-25)17-6-4-16(14-22)5-7-17/h4-8,13,15,19,23H,9-12H2,1-3H3