3-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)propanoate

Systemtic Name: 3-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)propanoate Openeye Name: 3-(4-bromo-2-isopropyl-5-methyl-phenoxy)propanoate CAS Name: 3-(4-bromo-5-methyl-2-propan-2-ylphenoxy)propanoate IUPAC Name: 3-(4-bromo-5-methyl-2-propan-2-ylphenoxy)propanoate Traditional Name: 3-(4-bromo-2-isopropyl-5-methyl-phenoxy)propionate Formula: C13H16BrO3- MolecularWeight: 300.16834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCCC(=O)[O-]

InChI

InChI=1S/C13H17BrO3/c1-8(2)10-7-11(14)9(3)6-12(10)17-5-4-13(15)16/h6-8H,4-5H2,1-3H3,(H,15,16)/p-1