methyl 3-(2-bromoethyl)-2-methyl-6-oxidanyl-4-(phenylmethoxymethyl)benzoate

Systemtic Name: methyl 3-(2-bromoethyl)-2-methyl-6-oxidanyl-4-(phenylmethoxymethyl)benzoate Openeye Name: methyl 4-(benzyloxymethyl)-3-(2-bromoethyl)-6-hydroxy-2-methyl-benzoate CAS Name: 3-(2-bromoethyl)-6-hydroxy-2-methyl-4-(phenylmethoxymethyl)benzoic acid methyl ester IUPAC Name: methyl 3-(2-bromoethyl)-6-hydroxy-2-methyl-4-(phenylmethoxymethyl)benzoate Traditional Name: 4-(benzoxymethyl)-3-(2-bromoethyl)-6-hydroxy-2-methyl-benzoic acid methyl ester Formula: C19H21BrO4 MolecularWeight: 393.27164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1C(=O)OC)O)COCC2=CC=CC=C2)CCBr

Isomeric SMILES

CC1=C(C(=CC(=C1C(=O)OC)O)COCC2=CC=CC=C2)CCBr

InChI

InChI=1S/C19H21BrO4/c1-13-16(8-9-20)15(10-17(21)18(13)19(22)23-2)12-24-11-14-6-4-3-5-7-14/h3-7,10,21H,8-9,11-12H2,1-2H3