ethyl 4-[3-(4-ethoxyphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(4-ethoxyphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(4-ethoxyphenyl)-2,4-dioxo-1H-pyrimidin-6-yl]piperazine-1-carboxylate CAS Name: 4-[3-(4-ethoxyphenyl)-2,4-dioxo-1H-pyrimidin-6-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-ethoxyphenyl)-2,4-dioxo-1H-pyrimidin-6-yl]piperazine-1-carboxylate Traditional Name: 4-(2,4-diketo-3-p-phenetyl-1H-pyrimidin-6-yl)piperazine-1-carboxylic acid ethyl ester Formula: C19H24N4O5 MolecularWeight: 388.41766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C=C(NC2=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C=C(NC2=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C19H24N4O5/c1-3-27-15-7-5-14(6-8-15)23-17(24)13-16(20-18(23)25)21-9-11-22(12-10-21)19(26)28-4-2/h5-8,13H,3-4,9-12H2,1-2H3,(H,20,25)