3-oxidanylidene-2-(phenylmethyl)pentanedioate

Systemtic Name: 3-oxidanylidene-2-(phenylmethyl)pentanedioate Openeye Name: 2-benzyl-3-oxo-pentanedioate CAS Name: 3-oxo-2-(phenylmethyl)pentanedioate IUPAC Name: 2-benzyl-3-oxopentanedioate Traditional Name: 2-benzyl-3-keto-glutarate Formula: C12H10O5-2 MolecularWeight: 234.2048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H12O5/c13-10(7-11(14)15)9(12(16)17)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,15)(H,16,17)/p-2