6-methyl-2-[4-(phenylmethyl)piperidin-1-yl]pyrimidine-4-carboxylate

Systemtic Name: 6-methyl-2-[4-(phenylmethyl)piperidin-1-yl]pyrimidine-4-carboxylate Openeye Name: 2-(4-benzyl-1-piperidyl)-6-methyl-pyrimidine-4-carboxylate CAS Name: 6-methyl-2-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinecarboxylate IUPAC Name: 2-(4-benzylpiperidin-1-yl)-6-methylpyrimidine-4-carboxylate Traditional Name: 2-(4-benzylpiperidino)-6-methyl-pyrimidine-4-carboxylate Formula: C18H20N3O2- MolecularWeight: 310.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)[O-])N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)[O-])N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O2/c1-13-11-16(17(22)23)20-18(19-13)21-9-7-15(8-10-21)12-14-5-3-2-4-6-14/h2-6,11,15H,7-10,12H2,1H3,(H,22,23)/p-1