methyl 4-chloranyl-2-[oxidanyl(phenyl)methyl]butanoate

Systemtic Name: methyl 4-chloranyl-2-[oxidanyl(phenyl)methyl]butanoate Openeye Name: methyl 4-chloro-2-[hydroxy(phenyl)methyl]butanoate CAS Name: 4-chloro-2-[hydroxy(phenyl)methyl]butanoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[hydroxy(phenyl)methyl]butanoate Traditional Name: 4-chloro-2-[hydroxy(phenyl)methyl]butyric acid methyl ester Formula: C12H15ClO3 MolecularWeight: 242.6987

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCl)C(C1=CC=CC=C1)O

Isomeric SMILES

COC(=O)C(CCCl)C(C1=CC=CC=C1)O

InChI

InChI=1S/C12H15ClO3/c1-16-12(15)10(7-8-13)11(14)9-5-3-2-4-6-9/h2-6,10-11,14H,7-8H2,1H3