ethyl 4-(4-methylphenyl)-2-oxidanylidene-6-(piperidin-1-ylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methylphenyl)-2-oxidanylidene-6-(piperidin-1-ylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-6-(1-piperidylmethyl)-4-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-methylphenyl)-2-oxo-6-(1-piperidinylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylphenyl)-2-oxo-6-(piperidin-1-ylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-(piperidinomethyl)-4-(p-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O3/c1-3-26-19(24)17-16(13-23-11-5-4-6-12-23)21-20(25)22-18(17)15-9-7-14(2)8-10-15/h7-10,18H,3-6,11-13H2,1-2H3,(H2,21,22,25)