phenethyl 2-chloranyl-2,3-dimethyl-3-oxidanyl-butanoate

Systemtic Name: phenethyl 2-chloranyl-2,3-dimethyl-3-oxidanyl-butanoate Openeye Name: phenethyl 2-chloro-3-hydroxy-2,3-dimethyl-butanoate CAS Name: 2-chloro-3-hydroxy-2,3-dimethylbutanoic acid phenethyl ester IUPAC Name: phenethyl 2-chloro-3-hydroxy-2,3-dimethylbutanoate Traditional Name: 2-chloro-3-hydroxy-2,3-dimethyl-butyric acid phenethyl ester Formula: C14H19ClO3 MolecularWeight: 270.75186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C)(C(=O)OCCC1=CC=CC=C1)Cl)O

Isomeric SMILES

CC(C)(C(C)(C(=O)OCCC1=CC=CC=C1)Cl)O

InChI

InChI=1S/C14H19ClO3/c1-13(2,17)14(3,15)12(16)18-10-9-11-7-5-4-6-8-11/h4-8,17H,9-10H2,1-3H3