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

Systemtic Name: 1-butyl-5-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 1-butyl-6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]pyrimidine-2,4-dione CAS Name: 1-butyl-6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]pyrimidine-2,4-dione IUPAC Name: 1-butyl-6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]pyrimidine-2,4-dione Traditional Name: 1-butyl-6-hydroxy-5-[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]pyrimidine-2,4-quinone Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)C(=O)C=CC2=CC(=C(C=C2)O)OC)O

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)C(=O)/C=C/C2=CC(=C(C=C2)O)OC)O

InChI

InChI=1S/C18H20N2O6/c1-3-4-9-20-17(24)15(16(23)19-18(20)25)13(22)8-6-11-5-7-12(21)14(10-11)26-2/h5-8,10,21,24H,3-4,9H2,1-2H3,(H,19,23,25)/b8-6+