ethyl 4-(4-methoxyphenyl)-2-oxidanylidene-6-[(3-phenylpiperidin-1-yl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-oxidanylidene-6-[(3-phenylpiperidin-1-yl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-oxo-6-[(3-phenyl-1-piperidyl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-oxo-6-[(3-phenyl-1-piperidinyl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-oxo-6-[(3-phenylpiperidin-1-yl)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-(4-methoxyphenyl)-6-[(3-phenylpiperidino)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CN3CCCC(C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CN3CCCC(C3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O4/c1-3-33-25(30)23-22(17-29-15-7-10-20(16-29)18-8-5-4-6-9-18)27-26(31)28-24(23)19-11-13-21(32-2)14-12-19/h4-6,8-9,11-14,20,24H,3,7,10,15-17H2,1-2H3,(H2,27,28,31)