3-(chloromethyl)cyclohexa-1,4-diene-1,3-dicarboxylic acid

Systemtic Name: 3-(chloromethyl)cyclohexa-1,4-diene-1,3-dicarboxylic acid Openeye Name: 3-(chloromethyl)cyclohexa-1,4-diene-1,3-dicarboxylic acid CAS Name: 3-(chloromethyl)cyclohexa-1,4-diene-1,3-dicarboxylic acid IUPAC Name: 3-(chloromethyl)cyclohexa-1,4-diene-1,3-dicarboxylic acid Traditional Name: 3-(chloromethyl)cyclohexa-1,4-diene-1,3-dicarboxylic acid Formula: C9H9ClO4 MolecularWeight: 216.61836

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C=C1C(=O)O)(CCl)C(=O)O

Isomeric SMILES

C1C=CC(C=C1C(=O)O)(CCl)C(=O)O

InChI

InChI=1S/C9H9ClO4/c10-5-9(8(13)14)3-1-2-6(4-9)7(11)12/h1,3-4H,2,5H2,(H,11,12)(H,13,14)