ethyl 1-[2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate CAS Name: 1-[2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-1-oxoethyl]-3-[(3-methoxyphenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetyl]-3-[(3-methoxyphenyl)methyl]piperidine-3-carboxylate Traditional Name: 1-[2-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)acetyl]-3-m-anisyl-nipecotic acid ethyl ester Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)CC2=C(NC(=NC2=O)C)C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)CC2=C(NC(=NC2=O)C)C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C24H31N3O5/c1-5-32-23(30)24(14-18-8-6-9-19(12-18)31-4)10-7-11-27(15-24)21(28)13-20-16(2)25-17(3)26-22(20)29/h6,8-9,12H,5,7,10-11,13-15H2,1-4H3,(H,25,26,29)