2-phenoxyethyl (E)-4-bromanyl-3-methyl-but-2-enoate

Systemtic Name: 2-phenoxyethyl (E)-4-bromanyl-3-methyl-but-2-enoate Openeye Name: 2-phenoxyethyl (E)-4-bromo-3-methyl-but-2-enoate CAS Name: (E)-4-bromo-3-methyl-2-butenoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (E)-4-bromo-3-methylbut-2-enoate Traditional Name: (E)-4-bromo-3-methyl-but-2-enoic acid 2-phenoxyethyl ester Formula: C13H15BrO3 MolecularWeight: 299.1604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCOC1=CC=CC=C1)CBr

Isomeric SMILES

C/C(=C\C(=O)OCCOC1=CC=CC=C1)/CBr

InChI

InChI=1S/C13H15BrO3/c1-11(10-14)9-13(15)17-8-7-16-12-5-3-2-4-6-12/h2-6,9H,7-8,10H2,1H3/b11-9+