(5-methyl-2-propan-2-yl-phenyl) 1,3-benzodioxole-5-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 1,3-benzodioxole-5-carboxylate Openeye Name: (2-isopropyl-5-methyl-phenyl) 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18O4/c1-11(2)14-6-4-12(3)8-16(14)22-18(19)13-5-7-15-17(9-13)21-10-20-15/h4-9,11H,10H2,1-3H3