tert-butyl 4-(4-pyridin-4-ylphenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-pyridin-4-ylphenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-pyridyl)phenyl]piperazine-1-carboxylate CAS Name: 4-(4-pyridin-4-ylphenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-pyridin-4-ylphenyl)piperazine-1-carboxylate Traditional Name: 4-[4-(4-pyridyl)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C20H25N3O2/c1-20(2,3)25-19(24)23-14-12-22(13-15-23)18-6-4-16(5-7-18)17-8-10-21-11-9-17/h4-11H,12-15H2,1-3H3