ethyl 4-[3-methoxy-4-(2-oxidanyl-3-piperidin-1-yl-propoxy)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[3-methoxy-4-(2-oxidanyl-3-piperidin-1-yl-propoxy)phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[2-hydroxy-3-(1-piperidyl)propoxy]-3-methoxy-phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[4-[2-hydroxy-3-(1-piperidinyl)propoxy]-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-hydroxy-3-piperidin-1-ylpropoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[4-(2-hydroxy-3-piperidino-propoxy)-3-methoxy-phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H33N3O6 MolecularWeight: 447.52462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)OCC(CN3CCCCC3)O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C=C2)OCC(CN3CCCCC3)O)OC)C

InChI

InChI=1S/C23H33N3O6/c1-4-31-22(28)20-15(2)24-23(29)25-21(20)16-8-9-18(19(12-16)30-3)32-14-17(27)13-26-10-6-5-7-11-26/h8-9,12,17,21,27H,4-7,10-11,13-14H2,1-3H3,(H2,24,25,29)