methyl 5-(3-chloranyl-4-oxidanyl-phenyl)-5-methyl-hexanoate

Systemtic Name: methyl 5-(3-chloranyl-4-oxidanyl-phenyl)-5-methyl-hexanoate Openeye Name: methyl 5-(3-chloro-4-hydroxy-phenyl)-5-methyl-hexanoate CAS Name: 5-(3-chloro-4-hydroxyphenyl)-5-methylhexanoic acid methyl ester IUPAC Name: methyl 5-(3-chloro-4-hydroxyphenyl)-5-methylhexanoate Traditional Name: 5-(3-chloro-4-hydroxy-phenyl)-5-methyl-hexanoic acid methyl ester Formula: C14H19ClO3 MolecularWeight: 270.75186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC(=O)OC)C1=CC(=C(C=C1)O)Cl

Isomeric SMILES

CC(C)(CCCC(=O)OC)C1=CC(=C(C=C1)O)Cl

InChI

InChI=1S/C14H19ClO3/c1-14(2,8-4-5-13(17)18-3)10-6-7-12(16)11(15)9-10/h6-7,9,16H,4-5,8H2,1-3H3