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

Systemtic Name: 3-methylidene-2,2-bis[1-oxidanylidene-1-(1-phenylethoxy)propan-2-yl]butanedioic acid Openeye Name: 3-methylene-2,2-bis[1-methyl-2-oxo-2-(1-phenylethoxy)ethyl]butanedioic acid CAS Name: 3-methylene-2,2-bis[1-oxo-1-(1-phenylethoxy)propan-2-yl]butanedioic acid IUPAC Name: 3-methylidene-2,2-bis[1-oxo-1-(1-phenylethoxy)propan-2-yl]butanedioic acid Traditional Name: 2,2-bis[2-keto-1-methyl-2-(1-phenylethoxy)ethyl]-3-methylene-succinic acid Formula: C27H30O8 MolecularWeight: 482.5223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C(C)C(C(C)C(=O)OC(C)C2=CC=CC=C2)(C(=C)C(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CC=CC=C1)OC(=O)C(C)C(C(C)C(=O)OC(C)C2=CC=CC=C2)(C(=C)C(=O)O)C(=O)O

InChI

InChI=1S/C27H30O8/c1-16(23(28)29)27(26(32)33,17(2)24(30)34-19(4)21-12-8-6-9-13-21)18(3)25(31)35-20(5)22-14-10-7-11-15-22/h6-15,17-20H,1H2,2-5H3,(H,28,29)(H,32,33)