6-(4-methylphenyl)-2-piperidin-1-yl-pyrimidine-4-carboxylate

Systemtic Name: 6-(4-methylphenyl)-2-piperidin-1-yl-pyrimidine-4-carboxylate Openeye Name: 2-(1-piperidyl)-6-(p-tolyl)pyrimidine-4-carboxylate CAS Name: 6-(4-methylphenyl)-2-(1-piperidinyl)-4-pyrimidinecarboxylate IUPAC Name: 6-(4-methylphenyl)-2-piperidin-1-ylpyrimidine-4-carboxylate Traditional Name: 2-piperidino-6-(p-tolyl)pyrimidine-4-carboxylate Formula: C17H18N3O2- MolecularWeight: 296.34372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCCCC3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=N2)N3CCCCC3)C(=O)[O-]

InChI

InChI=1S/C17H19N3O2/c1-12-5-7-13(8-6-12)14-11-15(16(21)22)19-17(18-14)20-9-3-2-4-10-20/h5-8,11H,2-4,9-10H2,1H3,(H,21,22)/p-1