2,2-diethyl-4-oxidanylidene-3,5-diphenyl-heptanedioic acid

Systemtic Name: 2,2-diethyl-4-oxidanylidene-3,5-diphenyl-heptanedioic acid Openeye Name: 2,2-diethyl-4-oxo-3,5-diphenyl-heptanedioic acid CAS Name: 2,2-diethyl-4-oxo-3,5-diphenylheptanedioic acid IUPAC Name: 2,2-diethyl-4-oxo-3,5-diphenylheptanedioic acid Traditional Name: 2,2-diethyl-4-keto-3,5-diphenyl-pimelic acid Formula: C23H26O5 MolecularWeight: 382.44954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26O5/c1-3-23(4-2,22(27)28)20(17-13-9-6-10-14-17)21(26)18(15-19(24)25)16-11-7-5-8-12-16/h5-14,18,20H,3-4,15H2,1-2H3,(H,24,25)(H,27,28)