6,6-bis(chloranyl)-4-(phenylmethyl)cyclohexa-2,4-diene-1,1-dicarboxylic acid

Systemtic Name: 6,6-bis(chloranyl)-4-(phenylmethyl)cyclohexa-2,4-diene-1,1-dicarboxylic acid Openeye Name: 4-benzyl-6,6-dichloro-cyclohexa-2,4-diene-1,1-dicarboxylic acid CAS Name: 6,6-dichloro-4-(phenylmethyl)cyclohexa-2,4-diene-1,1-dicarboxylic acid IUPAC Name: 4-benzyl-6,6-dichlorocyclohexa-2,4-diene-1,1-dicarboxylic acid Traditional Name: 4-benzyl-6,6-dichloro-cyclohexa-2,4-diene-1,1-dicarboxylic acid Formula: C15H12Cl2O4 MolecularWeight: 327.15938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(C(C=C2)(C(=O)O)C(=O)O)(Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(C(C=C2)(C(=O)O)C(=O)O)(Cl)Cl

InChI

InChI=1S/C15H12Cl2O4/c16-15(17)9-11(8-10-4-2-1-3-5-10)6-7-14(15,12(18)19)13(20)21/h1-7,9H,8H2,(H,18,19)(H,20,21)