3-[3-(hydroxymethyl)-4-oxidanyl-but-2-enyl]-6-(4-pentylphenyl)furo[2,3-d]pyrimidin-2-one

Systemtic Name: 3-[3-(hydroxymethyl)-4-oxidanyl-but-2-enyl]-6-(4-pentylphenyl)furo[2,3-d]pyrimidin-2-one Openeye Name: 3-[4-hydroxy-3-(hydroxymethyl)but-2-enyl]-6-(4-pentylphenyl)furo[2,3-d]pyrimidin-2-one CAS Name: 3-[4-hydroxy-3-(hydroxymethyl)but-2-enyl]-6-(4-pentylphenyl)-2-furo[2,3-d]pyrimidinone IUPAC Name: 3-[4-hydroxy-3-(hydroxymethyl)but-2-enyl]-6-(4-pentylphenyl)furo[2,3-d]pyrimidin-2-one Traditional Name: 6-(4-amylphenyl)-3-(4-hydroxy-3-methylol-but-2-enyl)furo[2,3-d]pyrimidin-2-one Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC3=CN(C(=O)N=C3O2)CC=C(CO)CO

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC3=CN(C(=O)N=C3O2)CC=C(CO)CO

InChI

InChI=1S/C22H26N2O4/c1-2-3-4-5-16-6-8-18(9-7-16)20-12-19-13-24(11-10-17(14-25)15-26)22(27)23-21(19)28-20/h6-10,12-13,25-26H,2-5,11,14-15H2,1H3