(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-(2-methylpropoxy)benzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-(2-methylpropoxy)benzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-isobutoxybenzoate CAS Name: 4-(2-methylpropoxy)benzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxybenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C19H19BrO5 MolecularWeight: 407.25516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C19H19BrO5/c1-12(2)9-22-15-5-3-13(4-6-15)19(21)23-10-14-7-17-18(8-16(14)20)25-11-24-17/h3-8,12H,9-11H2,1-2H3