ethyl 3-chloranyl-4-methoxy-2-oxidanyl-6-pentyl-benzoate

Systemtic Name: ethyl 3-chloranyl-4-methoxy-2-oxidanyl-6-pentyl-benzoate Openeye Name: ethyl 3-chloro-2-hydroxy-4-methoxy-6-pentyl-benzoate CAS Name: 3-chloro-2-hydroxy-4-methoxy-6-pentylbenzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-2-hydroxy-4-methoxy-6-pentylbenzoate Traditional Name: 6-amyl-3-chloro-2-hydroxy-4-methoxy-benzoic acid ethyl ester Formula: C15H21ClO4 MolecularWeight: 300.77784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C(=C1C(=O)OCC)O)Cl)OC

Isomeric SMILES

CCCCCC1=CC(=C(C(=C1C(=O)OCC)O)Cl)OC

InChI

InChI=1S/C15H21ClO4/c1-4-6-7-8-10-9-11(19-3)13(16)14(17)12(10)15(18)20-5-2/h9,17H,4-8H2,1-3H3