(4-methylcyclohexyl) 4-(4-ethoxyphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (4-methylcyclohexyl) 4-(4-ethoxyphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4-methylcyclohexyl) 4-(4-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 4-(4-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-methyl-4-p-phenetyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-methylcyclohexyl) ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OC3CCC(CC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OC3CCC(CC3)C

InChI

InChI=1S/C21H28N2O4/c1-4-26-16-11-7-15(8-12-16)19-18(14(3)22-21(25)23-19)20(24)27-17-9-5-13(2)6-10-17/h7-8,11-13,17,19H,4-6,9-10H2,1-3H3,(H2,22,23,25)