(2,5-dimethylphenyl) 3-bromanyl-4-butoxy-benzoate

Systemtic Name: (2,5-dimethylphenyl) 3-bromanyl-4-butoxy-benzoate Openeye Name: (2,5-dimethylphenyl) 3-bromo-4-butoxy-benzoate CAS Name: 3-bromo-4-butoxybenzoic acid (2,5-dimethylphenyl) ester IUPAC Name: (2,5-dimethylphenyl) 3-bromo-4-butoxybenzoate Traditional Name: 3-bromo-4-butoxy-benzoic acid (2,5-dimethylphenyl) ester Formula: C19H21BrO3 MolecularWeight: 377.27224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrO3/c1-4-5-10-22-17-9-8-15(12-16(17)20)19(21)23-18-11-13(2)6-7-14(18)3/h6-9,11-12H,4-5,10H2,1-3H3