2-(phenoxymethyl)-2-(phenylmethyl)propanedioate

Systemtic Name: 2-(phenoxymethyl)-2-(phenylmethyl)propanedioate Openeye Name: 2-benzyl-2-(phenoxymethyl)propanedioate CAS Name: 2-(phenoxymethyl)-2-(phenylmethyl)propanedioate IUPAC Name: 2-benzyl-2-(phenoxymethyl)propanedioate Traditional Name: 2-benzyl-2-(phenoxymethyl)malonate Formula: C17H14O5-2 MolecularWeight: 298.29006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(COC2=CC=CC=C2)(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(COC2=CC=CC=C2)(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H16O5/c18-15(19)17(16(20)21,11-13-7-3-1-4-8-13)12-22-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,18,19)(H,20,21)/p-2