5-[(4-bromophenyl)methyl]-4-oxidanyl-2-(4-prop-2-enoxyphenyl)-1H-pyrimidin-6-one

Systemtic Name: 5-[(4-bromophenyl)methyl]-4-oxidanyl-2-(4-prop-2-enoxyphenyl)-1H-pyrimidin-6-one Openeye Name: 2-(4-allyloxyphenyl)-5-[(4-bromophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one CAS Name: 5-[(4-bromophenyl)methyl]-4-hydroxy-2-(4-prop-2-enoxyphenyl)-1H-pyrimidin-6-one IUPAC Name: 5-[(4-bromophenyl)methyl]-4-hydroxy-2-(4-prop-2-enoxyphenyl)-1H-pyrimidin-6-one Traditional Name: 2-(4-allyloxyphenyl)-5-(4-bromobenzyl)-4-hydroxy-1H-pyrimidin-6-one Formula: C20H17BrN2O3 MolecularWeight: 413.26458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)CC3=CC=C(C=C3)Br)O

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)CC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C20H17BrN2O3/c1-2-11-26-16-9-5-14(6-10-16)18-22-19(24)17(20(25)23-18)12-13-3-7-15(21)8-4-13/h2-10H,1,11-12H2,(H2,22,23,24,25)