tert-butyl 3-oxidanylidene-4-(5-phenylpyridin-3-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 3-oxidanylidene-4-(5-phenylpyridin-3-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 3-oxo-4-(5-phenyl-3-pyridyl)piperazine-1-carboxylate CAS Name: 3-oxo-4-(5-phenyl-3-pyridinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-4-(5-phenylpyridin-3-yl)piperazine-1-carboxylate Traditional Name: 3-keto-4-(5-phenyl-3-pyridyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1)C2=CN=CC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1)C2=CN=CC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3/c1-20(2,3)26-19(25)22-9-10-23(18(24)14-22)17-11-16(12-21-13-17)15-7-5-4-6-8-15/h4-8,11-13H,9-10,14H2,1-3H3