3-methylidene-2,2-bis[1-oxidanylidene-1-(2-phenethyloxyethoxy)propan-2-yl]butanedioic acid

Systemtic Name: 3-methylidene-2,2-bis[1-oxidanylidene-1-(2-phenethyloxyethoxy)propan-2-yl]butanedioic acid Openeye Name: 3-methylene-2,2-bis[1-methyl-2-oxo-2-(2-phenethyloxyethoxy)ethyl]butanedioic acid CAS Name: 3-methylene-2,2-bis[1-oxo-1-(2-phenethyloxyethoxy)propan-2-yl]butanedioic acid IUPAC Name: 3-methylidene-2,2-bis[1-oxo-1-(2-phenethyloxyethoxy)propan-2-yl]butanedioic acid Traditional Name: 2,2-bis[2-keto-1-methyl-2-(2-phenethyloxyethoxy)ethyl]-3-methylene-succinic acid Formula: C31H38O10 MolecularWeight: 570.62742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCOCCC1=CC=CC=C1)C(C(C)C(=O)OCCOCCC2=CC=CC=C2)(C(=C)C(=O)O)C(=O)O

Isomeric SMILES

CC(C(=O)OCCOCCC1=CC=CC=C1)C(C(C)C(=O)OCCOCCC2=CC=CC=C2)(C(=C)C(=O)O)C(=O)O

InChI

InChI=1S/C31H38O10/c1-22(27(32)33)31(30(36)37,23(2)28(34)40-20-18-38-16-14-25-10-6-4-7-11-25)24(3)29(35)41-21-19-39-17-15-26-12-8-5-9-13-26/h4-13,23-24H,1,14-21H2,2-3H3,(H,32,33)(H,36,37)