butyl 3-chloranyl-2-methyl-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: butyl 3-chloranyl-2-methyl-2-oxidanyl-3-phenyl-propanoate Openeye Name: butyl 3-chloro-2-hydroxy-2-methyl-3-phenyl-propanoate CAS Name: 3-chloro-2-hydroxy-2-methyl-3-phenylpropanoic acid butyl ester IUPAC Name: butyl 3-chloro-2-hydroxy-2-methyl-3-phenylpropanoate Traditional Name: 3-chloro-2-hydroxy-2-methyl-3-phenyl-propionic acid butyl ester Formula: C14H19ClO3 MolecularWeight: 270.75186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClO3/c1-3-4-10-18-13(16)14(2,17)12(15)11-8-6-5-7-9-11/h5-9,12,17H,3-4,10H2,1-2H3