methyl 5-chloranyl-3-[(E)-hex-3-enyl]-2-oxidanyl-benzoate

Systemtic Name: methyl 5-chloranyl-3-[(E)-hex-3-enyl]-2-oxidanyl-benzoate Openeye Name: methyl 5-chloro-3-[(E)-hex-3-enyl]-2-hydroxy-benzoate CAS Name: 5-chloro-3-[(E)-hex-3-enyl]-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-3-[(E)-hex-3-enyl]-2-hydroxybenzoate Traditional Name: 5-chloro-3-[(E)-hex-3-enyl]-2-hydroxy-benzoic acid methyl ester Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCC1=C(C(=CC(=C1)Cl)C(=O)OC)O

Isomeric SMILES

CC/C=C/CCC1=C(C(=CC(=C1)Cl)C(=O)OC)O

InChI

InChI=1S/C14H17ClO3/c1-3-4-5-6-7-10-8-11(15)9-12(13(10)16)14(17)18-2/h4-5,8-9,16H,3,6-7H2,1-2H3/b5-4+