3-methylidene-2,2-bis[[4-(trifluoromethyl)phenyl]methyl]butanedioic acid

Systemtic Name: 3-methylidene-2,2-bis[[4-(trifluoromethyl)phenyl]methyl]butanedioic acid Openeye Name: 3-methylene-2,2-bis[[4-(trifluoromethyl)phenyl]methyl]butanedioic acid CAS Name: 3-methylene-2,2-bis[[4-(trifluoromethyl)phenyl]methyl]butanedioic acid IUPAC Name: 3-methylidene-2,2-bis[[4-(trifluoromethyl)phenyl]methyl]butanedioic acid Traditional Name: 3-methylene-2,2-bis[4-(trifluoromethyl)benzyl]succinic acid Formula: C21H16F6O4 MolecularWeight: 446.339759

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)O)C(CC1=CC=C(C=C1)C(F)(F)F)(CC2=CC=C(C=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

C=C(C(=O)O)C(CC1=CC=C(C=C1)C(F)(F)F)(CC2=CC=C(C=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C21H16F6O4/c1-12(17(28)29)19(18(30)31,10-13-2-6-15(7-3-13)20(22,23)24)11-14-4-8-16(9-5-14)21(25,26)27/h2-9H,1,10-11H2,(H,28,29)(H,30,31)