2,2-bis(4-propoxycarbonylphenyl)pentanedioate

Systemtic Name: 2,2-bis(4-propoxycarbonylphenyl)pentanedioate Openeye Name: 2,2-bis(4-propoxycarbonylphenyl)pentanedioate CAS Name: 2,2-bis[4-[oxo(propoxy)methyl]phenyl]pentanedioate IUPAC Name: 2,2-bis(4-propoxycarbonylphenyl)pentanedioate Traditional Name: 2,2-bis(4-propoxycarbonylphenyl)glutarate Formula: C25H26O8-2 MolecularWeight: 454.46914

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)C(CCC(=O)[O-])(C2=CC=C(C=C2)C(=O)OCCC)C(=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)C(CCC(=O)[O-])(C2=CC=C(C=C2)C(=O)OCCC)C(=O)[O-]

InChI

InChI=1S/C25H28O8/c1-3-15-32-22(28)17-5-9-19(10-6-17)25(24(30)31,14-13-21(26)27)20-11-7-18(8-12-20)23(29)33-16-4-2/h5-12H,3-4,13-16H2,1-2H3,(H,26,27)(H,30,31)/p-2