[4-(5-ethanoyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenyl] benzoate

Systemtic Name: [4-(5-ethanoyl-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenyl] benzoate Openeye Name: [4-(5-acetyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenyl] benzoate CAS Name: benzoic acid [4-(5-acetyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxyphenyl] ester IUPAC Name: [4-(5-acetyl-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxyphenyl] benzoate Traditional Name: benzoic acid [4-(5-acetyl-2-keto-6-methyl-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5/c1-4-28-18-12-16(20-19(14(3)25)13(2)23-22(27)24-20)10-11-17(18)29-21(26)15-8-6-5-7-9-15/h5-12,20H,4H2,1-3H3,(H2,23,24,27)