2-(6-propan-2-yl-1,3-benzodioxol-5-yl)ethanoic acid

Systemtic Name: 2-(6-propan-2-yl-1,3-benzodioxol-5-yl)ethanoic acid Openeye Name: 2-(6-isopropyl-1,3-benzodioxol-5-yl)acetic acid CAS Name: 2-(6-propan-2-yl-1,3-benzodioxol-5-yl)acetic acid IUPAC Name: 2-(6-propan-2-yl-1,3-benzodioxol-5-yl)acetic acid Traditional Name: 2-(6-isopropyl-1,3-benzodioxol-5-yl)acetic acid Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1CC(=O)O)OCO2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1CC(=O)O)OCO2

InChI

InChI=1S/C12H14O4/c1-7(2)9-5-11-10(15-6-16-11)3-8(9)4-12(13)14/h3,5,7H,4,6H2,1-2H3,(H,13,14)