methyl 4-(3-methoxyphenyl)-1-pyrimidin-2-yl-piperidine-4-carboxylate

Systemtic Name: methyl 4-(3-methoxyphenyl)-1-pyrimidin-2-yl-piperidine-4-carboxylate Openeye Name: methyl 4-(3-methoxyphenyl)-1-pyrimidin-2-yl-piperidine-4-carboxylate CAS Name: 4-(3-methoxyphenyl)-1-(2-pyrimidinyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-methoxyphenyl)-1-pyrimidin-2-ylpiperidine-4-carboxylate Traditional Name: 4-(3-methoxyphenyl)-1-(2-pyrimidyl)isonipecotic acid methyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCN(CC2)C3=NC=CC=N3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCN(CC2)C3=NC=CC=N3)C(=O)OC

InChI

InChI=1S/C18H21N3O3/c1-23-15-6-3-5-14(13-15)18(16(22)24-2)7-11-21(12-8-18)17-19-9-4-10-20-17/h3-6,9-10,13H,7-8,11-12H2,1-2H3