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

Systemtic Name: 2-[2-(2-hexoxyethoxy)-2-oxidanylidene-ethyl]-3-methylidene-2-phenyl-butanedioic acid Openeye Name: 2-[2-(2-hexoxyethoxy)-2-oxo-ethyl]-3-methylene-2-phenyl-butanedioic acid CAS Name: 2-[2-(2-hexoxyethoxy)-2-oxoethyl]-3-methylene-2-phenylbutanedioic acid IUPAC Name: 2-[2-(2-hexoxyethoxy)-2-oxoethyl]-3-methylidene-2-phenylbutanedioic acid Traditional Name: 2-[2-(2-hexoxyethoxy)-2-keto-ethyl]-3-methylene-2-phenyl-succinic acid Formula: C21H28O7 MolecularWeight: 392.44282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28O7/c1-3-4-5-9-12-27-13-14-28-18(22)15-21(20(25)26,16(2)19(23)24)17-10-7-6-8-11-17/h6-8,10-11H,2-5,9,12-15H2,1H3,(H,23,24)(H,25,26)