[2-methoxy-5-[(1R)-1-oxidanylethyl]phenyl] 2-bromanyl-3-methyl-benzoate

Systemtic Name: [2-methoxy-5-[(1R)-1-oxidanylethyl]phenyl] 2-bromanyl-3-methyl-benzoate Openeye Name: [5-[(1R)-1-hydroxyethyl]-2-methoxy-phenyl] 2-bromo-3-methyl-benzoate CAS Name: 2-bromo-3-methylbenzoic acid [5-[(1R)-1-hydroxyethyl]-2-methoxyphenyl] ester IUPAC Name: [5-[(1R)-1-hydroxyethyl]-2-methoxyphenyl] 2-bromo-3-methylbenzoate Traditional Name: 2-bromo-3-methyl-benzoic acid [5-[(1R)-1-hydroxyethyl]-2-methoxy-phenyl] ester Formula: C17H17BrO4 MolecularWeight: 365.21848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1Br)C(=O)OC2=C(C=CC(=C2)C(C)O)OC

Isomeric SMILES

CC1=CC=CC(=C1Br)C(=O)OC2=C(C=CC(=C2)[C@@H](C)O)OC

InChI

InChI=1S/C17H17BrO4/c1-10-5-4-6-13(16(10)18)17(20)22-15-9-12(11(2)19)7-8-14(15)21-3/h4-9,11,19H,1-3H3/t11-/m1/s1