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

Systemtic Name: 5-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]-1-(2-methoxyphenyl)-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]-1-(2-methoxyphenyl)pyrimidine-2,4-dione CAS Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]-1-(2-methoxyphenyl)pyrimidine-2,4-dione IUPAC Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-1-(2-methoxyphenyl)pyrimidine-2,4-dione Traditional Name: 6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]-1-(2-methoxyphenyl)pyrimidine-2,4-quinone Formula: C21H18N2O7 MolecularWeight: 410.37682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=C(C(=O)NC2=O)C(=O)C=CC3=CC(=C(C=C3)O)OC)O

Isomeric SMILES

COC1=CC=CC=C1N2C(=C(C(=O)NC2=O)C(=O)/C=C/C3=CC(=C(C=C3)O)OC)O

InChI

InChI=1S/C21H18N2O7/c1-29-16-6-4-3-5-13(16)23-20(27)18(19(26)22-21(23)28)15(25)10-8-12-7-9-14(24)17(11-12)30-2/h3-11,24,27H,1-2H3,(H,22,26,28)/b10-8+