(3-methylphenyl) 4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoate

Systemtic Name: (3-methylphenyl) 4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoate Openeye Name: m-tolyl 4-(2-bromo-4-isopropyl-phenoxy)butanoate CAS Name: 4-(2-bromo-4-propan-2-ylphenoxy)butanoic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 4-(2-bromo-4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(2-bromo-4-isopropyl-phenoxy)butyric acid m-tolyl ester Formula: C20H23BrO3 MolecularWeight: 391.29882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br

InChI

InChI=1S/C20H23BrO3/c1-14(2)16-9-10-19(18(21)13-16)23-11-5-8-20(22)24-17-7-4-6-15(3)12-17/h4,6-7,9-10,12-14H,5,8,11H2,1-3H3