4-azanyl-1-[3,4-bis(hydroxymethyl)oxetan-2-yl]-5-[(E)-2-bromanylethenyl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[3,4-bis(hydroxymethyl)oxetan-2-yl]-5-[(E)-2-bromanylethenyl]pyrimidin-2-one Openeye Name: 4-amino-1-[3,4-bis(hydroxymethyl)oxetan-2-yl]-5-[(E)-2-bromovinyl]pyrimidin-2-one CAS Name: 4-amino-1-[3,4-bis(hydroxymethyl)-2-oxetanyl]-5-[(E)-2-bromoethenyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[3,4-bis(hydroxymethyl)oxetan-2-yl]-5-[(E)-2-bromoethenyl]pyrimidin-2-one Traditional Name: 4-amino-5-[(E)-2-bromovinyl]-1-(3,4-dimethyloloxetan-2-yl)pyrimidin-2-one Formula: C11H14BrN3O4 MolecularWeight: 332.15056

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NC(=O)N1C2C(C(O2)CO)CO)N)C=CBr

Isomeric SMILES

C1=C(C(=NC(=O)N1C2C(C(O2)CO)CO)N)/C=C/Br

InChI

InChI=1S/C11H14BrN3O4/c12-2-1-6-3-15(11(18)14-9(6)13)10-7(4-16)8(5-17)19-10/h1-3,7-8,10,16-17H,4-5H2,(H2,13,14,18)/b2-1+