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

Systemtic Name: 3-methylidene-2,2-bis[1-(3-methylphenoxy)-1-oxidanylidene-propan-2-yl]butanedioic acid Openeye Name: 3-methylene-2,2-bis[1-methyl-2-(3-methylphenoxy)-2-oxo-ethyl]butanedioic acid CAS Name: 3-methylene-2,2-bis[1-(3-methylphenoxy)-1-oxopropan-2-yl]butanedioic acid IUPAC Name: 3-methylidene-2,2-bis[1-(3-methylphenoxy)-1-oxopropan-2-yl]butanedioic acid Traditional Name: 2,2-bis[2-keto-1-methyl-2-(3-methylphenoxy)ethyl]-3-methylene-succinic acid Formula: C25H26O8 MolecularWeight: 454.46914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C(C)C(C(C)C(=O)OC2=CC=CC(=C2)C)(C(=C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C(C)C(C(C)C(=O)OC2=CC=CC(=C2)C)(C(=C)C(=O)O)C(=O)O

InChI

InChI=1S/C25H26O8/c1-14-8-6-10-19(12-14)32-22(28)17(4)25(24(30)31,16(3)21(26)27)18(5)23(29)33-20-11-7-9-15(2)13-20/h6-13,17-18H,3H2,1-2,4-5H3,(H,26,27)(H,30,31)