(2-bromanyl-4-tert-butyl-phenyl) 4-butoxybenzoate

Systemtic Name: (2-bromanyl-4-tert-butyl-phenyl) 4-butoxybenzoate Openeye Name: (2-bromo-4-tert-butyl-phenyl) 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid (2-bromo-4-tert-butylphenyl) ester IUPAC Name: (2-bromo-4-tert-butylphenyl) 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid (2-bromo-4-tert-butyl-phenyl) ester Formula: C21H25BrO3 MolecularWeight: 405.3254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C21H25BrO3/c1-5-6-13-24-17-10-7-15(8-11-17)20(23)25-19-12-9-16(14-18(19)22)21(2,3)4/h7-12,14H,5-6,13H2,1-4H3