4-bromanylbutyl 2-(hydroxymethyl)-2-methyl-3-oxidanyl-propanoate

Systemtic Name: 4-bromanylbutyl 2-(hydroxymethyl)-2-methyl-3-oxidanyl-propanoate Openeye Name: 4-bromobutyl 3-hydroxy-2-(hydroxymethyl)-2-methyl-propanoate CAS Name: 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoic acid 4-bromobutyl ester IUPAC Name: 4-bromobutyl 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate Traditional Name: 3-hydroxy-2-methyl-2-methylol-propionic acid 4-bromobutyl ester Formula: C9H17BrO4 MolecularWeight: 269.13288

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)C(=O)OCCCCBr

Isomeric SMILES

CC(CO)(CO)C(=O)OCCCCBr

InChI

InChI=1S/C9H17BrO4/c1-9(6-11,7-12)8(13)14-5-3-2-4-10/h11-12H,2-7H2,1H3