1-[1,3-bis(bromanyl)propan-2-yloxymethyl]-4-methoxy-5-[(3-phenylmethoxyphenyl)methyl]pyrimidin-2-one

Systemtic Name: 1-[1,3-bis(bromanyl)propan-2-yloxymethyl]-4-methoxy-5-[(3-phenylmethoxyphenyl)methyl]pyrimidin-2-one Openeye Name: 5-[(3-benzyloxyphenyl)methyl]-1-[[2-bromo-1-(bromomethyl)ethoxy]methyl]-4-methoxy-pyrimidin-2-one CAS Name: 1-(1,3-dibromopropan-2-yloxymethyl)-4-methoxy-5-[(3-phenylmethoxyphenyl)methyl]-2-pyrimidinone IUPAC Name: 1-(1,3-dibromopropan-2-yloxymethyl)-4-methoxy-5-[(3-phenylmethoxyphenyl)methyl]pyrimidin-2-one Traditional Name: 5-(3-benzoxybenzyl)-1-[[2-bromo-1-(bromomethyl)ethoxy]methyl]-4-methoxy-pyrimidin-2-one Formula: C23H24Br2N2O4 MolecularWeight: 552.25566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=O)N(C=C1CC2=CC(=CC=C2)OCC3=CC=CC=C3)COC(CBr)CBr

Isomeric SMILES

COC1=NC(=O)N(C=C1CC2=CC(=CC=C2)OCC3=CC=CC=C3)COC(CBr)CBr

InChI

InChI=1S/C23H24Br2N2O4/c1-29-22-19(14-27(23(28)26-22)16-31-21(12-24)13-25)10-18-8-5-9-20(11-18)30-15-17-6-3-2-4-7-17/h2-9,11,14,21H,10,12-13,15-16H2,1H3