methyl 5-chloranyl-4-octoxy-2-oxidanyl-benzoate

Systemtic Name: methyl 5-chloranyl-4-octoxy-2-oxidanyl-benzoate Openeye Name: methyl 5-chloro-2-hydroxy-4-octoxy-benzoate CAS Name: 5-chloro-2-hydroxy-4-octoxybenzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-hydroxy-4-octoxybenzoate Traditional Name: 5-chloro-2-hydroxy-4-octoxy-benzoic acid methyl ester Formula: C16H23ClO4 MolecularWeight: 314.80442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C(=C1)O)C(=O)OC)Cl

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C(=C1)O)C(=O)OC)Cl

InChI

InChI=1S/C16H23ClO4/c1-3-4-5-6-7-8-9-21-15-11-14(18)12(10-13(15)17)16(19)20-2/h10-11,18H,3-9H2,1-2H3