5-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]-6-oxidanyl-1-phenethyl-pyrimidine-2,4-dione

Systemtic Name: 5-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]-6-oxidanyl-1-phenethyl-pyrimidine-2,4-dione Openeye Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]-1-phenethyl-pyrimidine-2,4-dione CAS Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]-1-phenethylpyrimidine-2,4-dione IUPAC Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-1-phenethylpyrimidine-2,4-dione Traditional Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]-1-phenethyl-pyrimidine-2,4-quinone Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=C(N(C(=O)NC2=O)CCC3=CC=CC=C3)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=C(N(C(=O)NC2=O)CCC3=CC=CC=C3)O)O

InChI

InChI=1S/C22H20N2O6/c1-30-18-13-15(7-9-16(18)25)8-10-17(26)19-20(27)23-22(29)24(21(19)28)12-11-14-5-3-2-4-6-14/h2-10,13,25,28H,11-12H2,1H3,(H,23,27,29)/b10-8+