4,5-bis(chloranyl)-2-(4-methylpentoxycarbonyl)benzoic acid

Systemtic Name: 4,5-bis(chloranyl)-2-(4-methylpentoxycarbonyl)benzoic acid Openeye Name: 4,5-dichloro-2-isohexyloxycarbonyl-benzoic acid CAS Name: 4,5-dichloro-2-[4-methylpentoxy(oxo)methyl]benzoic acid IUPAC Name: 4,5-dichloro-2-(4-methylpentoxycarbonyl)benzoic acid Traditional Name: 4,5-dichloro-2-isohexyloxycarbonyl-benzoic acid Formula: C14H16Cl2O4 MolecularWeight: 319.18044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C1=CC(=C(C=C1C(=O)O)Cl)Cl

Isomeric SMILES

CC(C)CCCOC(=O)C1=CC(=C(C=C1C(=O)O)Cl)Cl

InChI

InChI=1S/C14H16Cl2O4/c1-8(2)4-3-5-20-14(19)10-7-12(16)11(15)6-9(10)13(17)18/h6-8H,3-5H2,1-2H3,(H,17,18)