3-chloranyl-6-propan-2-yl-phthalic acid

Systemtic Name: 3-chloranyl-6-propan-2-yl-phthalic acid Openeye Name: 3-chloro-6-isopropyl-phthalic acid CAS Name: 3-chloro-6-propan-2-ylphthalic acid IUPAC Name: 3-chloro-6-propan-2-ylphthalic acid Traditional Name: 3-chloro-6-isopropyl-phthalic acid Formula: C11H11ClO4 MolecularWeight: 242.65564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1)Cl)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C11H11ClO4/c1-5(2)6-3-4-7(12)9(11(15)16)8(6)10(13)14/h3-5H,1-2H3,(H,13,14)(H,15,16)