(4-bromanyl-2-propan-2-yl-phenyl) 4-(3-methylbutoxy)benzoate

Systemtic Name: (4-bromanyl-2-propan-2-yl-phenyl) 4-(3-methylbutoxy)benzoate Openeye Name: (4-bromo-2-isopropyl-phenyl) 4-isopentyloxybenzoate CAS Name: 4-(3-methylbutoxy)benzoic acid (4-bromo-2-propan-2-ylphenyl) ester IUPAC Name: (4-bromo-2-propan-2-ylphenyl) 4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxybenzoic acid (4-bromo-2-isopropyl-phenyl) ester Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C(C)C

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C(C)C

InChI

InChI=1S/C21H25BrO3/c1-14(2)11-12-24-18-8-5-16(6-9-18)21(23)25-20-10-7-17(22)13-19(20)15(3)4/h5-10,13-15H,11-12H2,1-4H3