2-[(E,4E)-4-(3-chloranyl-5,5-dimethyl-cyclohex-2-en-1-ylidene)but-2-enylidene]propanedioic acid

Systemtic Name: 2-[(E,4E)-4-(3-chloranyl-5,5-dimethyl-cyclohex-2-en-1-ylidene)but-2-enylidene]propanedioic acid Openeye Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethyl-cyclohex-2-en-1-ylidene)but-2-enylidene]propanedioic acid CAS Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethyl-1-cyclohex-2-enylidene)but-2-enylidene]propanedioic acid IUPAC Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethylcyclohex-2-en-1-ylidene)but-2-enylidene]propanedioic acid Traditional Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethyl-cyclohex-2-en-1-ylidene)but-2-enylidene]malonic acid Formula: C15H17ClO4 MolecularWeight: 296.74608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=CC=CC=C(C(=O)O)C(=O)O)C1)Cl)C

Isomeric SMILES

CC1(CC(=C/C(=C/C=C/C=C(C(=O)O)C(=O)O)/C1)Cl)C

InChI

InChI=1S/C15H17ClO4/c1-15(2)8-10(7-11(16)9-15)5-3-4-6-12(13(17)18)14(19)20/h3-7H,8-9H2,1-2H3,(H,17,18)(H,19,20)/b4-3+,10-5-