1-[[(2S,3S)-1-bromanyl-3-phenylmethoxy-butan-2-yl]oxymethyl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[[(2S,3S)-1-bromanyl-3-phenylmethoxy-butan-2-yl]oxymethyl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[[(1S,2S)-2-benzyloxy-1-(bromomethyl)propoxy]methyl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[[(2S,3S)-1-bromo-3-phenylmethoxybutan-2-yl]oxymethyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[[(2S,3S)-1-bromo-3-phenylmethoxybutan-2-yl]oxymethyl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[[(1S,2S)-2-benzoxy-1-(bromomethyl)propoxy]methyl]-5-methyl-pyrimidine-2,4-quinone Formula: C17H21BrN2O4 MolecularWeight: 397.26364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)COC(CBr)C(C)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CO[C@H](CBr)[C@H](C)OCC2=CC=CC=C2

InChI

InChI=1S/C17H21BrN2O4/c1-12-9-20(17(22)19-16(12)21)11-24-15(8-18)13(2)23-10-14-6-4-3-5-7-14/h3-7,9,13,15H,8,10-11H2,1-2H3,(H,19,21,22)/t13-,15+/m0/s1