5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1-(4-ethoxyphenyl)-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1-(4-ethoxyphenyl)-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1-(4-ethoxyphenyl)-6-hydroxy-pyrimidine-2,4-dione CAS Name: 5-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-1-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4-dione IUPAC Name: 5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-1-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4-dione Traditional Name: 5-[(E)-3-(4-chlorophenyl)acryloyl]-6-hydroxy-1-p-phenetyl-pyrimidine-2,4-quinone Formula: C21H17ClN2O5 MolecularWeight: 412.82308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C(=O)C=CC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C(=O)/C=C/C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C21H17ClN2O5/c1-2-29-16-10-8-15(9-11-16)24-20(27)18(19(26)23-21(24)28)17(25)12-5-13-3-6-14(22)7-4-13/h3-12,27H,2H2,1H3,(H,23,26,28)/b12-5+