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

Systemtic Name: 2-[(E,4E)-4-(3-chloranyl-5,5-dimethyl-cyclohex-2-en-1-ylidene)-2-methyl-but-2-enylidene]propanedioic acid Openeye Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethyl-cyclohex-2-en-1-ylidene)-2-methyl-but-2-enylidene]propanedioic acid CAS Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethyl-1-cyclohex-2-enylidene)-2-methylbut-2-enylidene]propanedioic acid IUPAC Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethylcyclohex-2-en-1-ylidene)-2-methylbut-2-enylidene]propanedioic acid Traditional Name: 2-[(E,4E)-4-(3-chloro-5,5-dimethyl-cyclohex-2-en-1-ylidene)-2-methyl-but-2-enylidene]malonic acid Formula: C16H19ClO4 MolecularWeight: 310.77266

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=C1CC(CC(=C1)Cl)(C)C)C=C(C(=O)O)C(=O)O

Isomeric SMILES

C/C(=C\C=C\1/CC(CC(=C1)Cl)(C)C)/C=C(C(=O)O)C(=O)O

InChI

InChI=1S/C16H19ClO4/c1-10(6-13(14(18)19)15(20)21)4-5-11-7-12(17)9-16(2,3)8-11/h4-7H,8-9H2,1-3H3,(H,18,19)(H,20,21)/b10-4+,11-5-