2-[2-(2-hexoxyethoxy)-2-oxidanylidene-ethyl]-3-methylidene-2-(4-methylphenyl)butanedioic acid

Systemtic Name: 2-[2-(2-hexoxyethoxy)-2-oxidanylidene-ethyl]-3-methylidene-2-(4-methylphenyl)butanedioic acid Openeye Name: 2-[2-(2-hexoxyethoxy)-2-oxo-ethyl]-3-methylene-2-(p-tolyl)butanedioic acid CAS Name: 2-[2-(2-hexoxyethoxy)-2-oxoethyl]-3-methylene-2-(4-methylphenyl)butanedioic acid IUPAC Name: 2-[2-(2-hexoxyethoxy)-2-oxoethyl]-3-methylidene-2-(4-methylphenyl)butanedioic acid Traditional Name: 2-[2-(2-hexoxyethoxy)-2-keto-ethyl]-3-methylene-2-(p-tolyl)succinic acid Formula: C22H30O7 MolecularWeight: 406.4694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCOC(=O)CC(C1=CC=C(C=C1)C)(C(=C)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCOCCOC(=O)CC(C1=CC=C(C=C1)C)(C(=C)C(=O)O)C(=O)O

InChI

InChI=1S/C22H30O7/c1-4-5-6-7-12-28-13-14-29-19(23)15-22(21(26)27,17(3)20(24)25)18-10-8-16(2)9-11-18/h8-11H,3-7,12-15H2,1-2H3,(H,24,25)(H,26,27)