2,2-bis(4-phenylmethoxybutyl)propanedioic acid

Systemtic Name: 2,2-bis(4-phenylmethoxybutyl)propanedioic acid Openeye Name: 2,2-bis(4-benzyloxybutyl)propanedioic acid CAS Name: 2,2-bis(4-phenylmethoxybutyl)propanedioic acid IUPAC Name: 2,2-bis(4-phenylmethoxybutyl)propanedioic acid Traditional Name: 2,2-bis(4-benzoxybutyl)malonic acid Formula: C25H32O6 MolecularWeight: 428.51798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCCC(CCCCOCC2=CC=CC=C2)(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCCCC(CCCCOCC2=CC=CC=C2)(C(=O)O)C(=O)O

InChI

InChI=1S/C25H32O6/c26-23(27)25(24(28)29,15-7-9-17-30-19-21-11-3-1-4-12-21)16-8-10-18-31-20-22-13-5-2-6-14-22/h1-6,11-14H,7-10,15-20H2,(H,26,27)(H,28,29)