(6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-propan-2-ylbenzoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 4-propan-2-ylbenzoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C18H17BrO4 MolecularWeight: 377.22918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO4/c1-11(2)12-3-5-13(6-4-12)18(20)21-9-14-7-16-17(8-15(14)19)23-10-22-16/h3-8,11H,9-10H2,1-2H3