methyl 3-(2-chloroethyl)-5-ethyl-4-(hydroxymethyl)-2-methyl-6-oxidanyl-benzoate

Systemtic Name: methyl 3-(2-chloroethyl)-5-ethyl-4-(hydroxymethyl)-2-methyl-6-oxidanyl-benzoate Openeye Name: methyl 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(hydroxymethyl)-6-methyl-benzoate CAS Name: 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(hydroxymethyl)-6-methylbenzoic acid methyl ester IUPAC Name: methyl 5-(2-chloroethyl)-3-ethyl-2-hydroxy-4-(hydroxymethyl)-6-methylbenzoate Traditional Name: 5-(2-chloroethyl)-3-ethyl-2-hydroxy-6-methyl-4-methylol-benzoic acid methyl ester Formula: C14H19ClO4 MolecularWeight: 286.75126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1CO)CCCl)C)C(=O)OC)O

Isomeric SMILES

CCC1=C(C(=C(C(=C1CO)CCCl)C)C(=O)OC)O

InChI

InChI=1S/C14H19ClO4/c1-4-9-11(7-16)10(5-6-15)8(2)12(13(9)17)14(18)19-3/h16-17H,4-7H2,1-3H3