methyl 5-chloranyl-2-methylidene-4-oxidanyl-4-phenyl-pentanoate

Systemtic Name: methyl 5-chloranyl-2-methylidene-4-oxidanyl-4-phenyl-pentanoate Openeye Name: methyl 5-chloro-4-hydroxy-2-methylene-4-phenyl-pentanoate CAS Name: 5-chloro-4-hydroxy-2-methylene-4-phenylpentanoic acid methyl ester IUPAC Name: methyl 5-chloro-4-hydroxy-2-methylidene-4-phenylpentanoate Traditional Name: 2-(3-chloro-2-hydroxy-2-phenyl-propyl)acrylic acid methyl ester Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClO3/c1-10(12(15)17-2)8-13(16,9-14)11-6-4-3-5-7-11/h3-7,16H,1,8-9H2,2H3