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

Systemtic Name: ethyl 6-methyl-2-oxidanylidene-4-[4-(2-oxidanyl-3-piperidin-1-yl-propoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[2-hydroxy-3-(1-piperidyl)propoxy]phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[4-[2-hydroxy-3-(1-piperidinyl)propoxy]phenyl]-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)phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[4-(2-hydroxy-3-piperidino-propoxy)phenyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O5/c1-3-29-21(27)19-15(2)23-22(28)24-20(19)16-7-9-18(10-8-16)30-14-17(26)13-25-11-5-4-6-12-25/h7-10,17,20,26H,3-6,11-14H2,1-2H3,(H2,23,24,28)