2-phenoxyethyl 3-bromanyl-4-methyl-benzoate

Systemtic Name: 2-phenoxyethyl 3-bromanyl-4-methyl-benzoate Openeye Name: 2-phenoxyethyl 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid 2-phenoxyethyl ester Formula: C16H15BrO3 MolecularWeight: 335.1925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCOC2=CC=CC=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCOC2=CC=CC=C2)Br

InChI

InChI=1S/C16H15BrO3/c1-12-7-8-13(11-15(12)17)16(18)20-10-9-19-14-5-3-2-4-6-14/h2-8,11H,9-10H2,1H3