1-(6-tert-butyl-4-oxidanylidene-1H-pyrimidin-2-yl)piperidine-4-carboxylate

Systemtic Name: 1-(6-tert-butyl-4-oxidanylidene-1H-pyrimidin-2-yl)piperidine-4-carboxylate Openeye Name: 1-(6-tert-butyl-4-oxo-1H-pyrimidin-2-yl)piperidine-4-carboxylate CAS Name: 1-(6-tert-butyl-4-oxo-1H-pyrimidin-2-yl)-4-piperidinecarboxylate IUPAC Name: 1-(6-tert-butyl-4-oxo-1H-pyrimidin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(6-tert-butyl-4-keto-1H-pyrimidin-2-yl)isonipecotate Formula: C14H20N3O3- MolecularWeight: 278.3269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=O)N=C(N1)N2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=O)N=C(N1)N2CCC(CC2)C(=O)[O-]

InChI

InChI=1S/C14H21N3O3/c1-14(2,3)10-8-11(18)16-13(15-10)17-6-4-9(5-7-17)12(19)20/h8-9H,4-7H2,1-3H3,(H,19,20)(H,15,16,18)/p-1