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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br

Isomeric SMILES

CC1=CC=CC=C1OC(=O)CCCOC2=C(C=C(C=C2)C(C)C)Br

InChI

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