(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-tert-butylbenzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-tert-butylbenzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C19H19BrO4 MolecularWeight: 391.25576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrO4/c1-19(2,3)14-6-4-12(5-7-14)18(21)22-10-13-8-16-17(9-15(13)20)24-11-23-16/h4-9H,10-11H2,1-3H3