(6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-(4-methylphenyl)ethanoate

Systemtic Name: (6-bromanyl-1,3-benzodioxol-5-yl)methyl 2-(4-methylphenyl)ethanoate Openeye Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-(p-tolyl)acetate CAS Name: 2-(4-methylphenyl)acetic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-bromo-1,3-benzodioxol-5-yl)methyl 2-(4-methylphenyl)acetate Traditional Name: 2-(p-tolyl)acetic acid (6-bromo-1,3-benzodioxol-5-yl)methyl ester Formula: C17H15BrO4 MolecularWeight: 363.2026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(=O)OCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)CC(=O)OCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C17H15BrO4/c1-11-2-4-12(5-3-11)6-17(19)20-9-13-7-15-16(8-14(13)18)22-10-21-15/h2-5,7-8H,6,9-10H2,1H3