2-(6-ethoxyhexyl)-3-methylidene-2-(2-oxidanylidene-2-phenylmethoxy-ethyl)butanedioate

Systemtic Name: 2-(6-ethoxyhexyl)-3-methylidene-2-(2-oxidanylidene-2-phenylmethoxy-ethyl)butanedioate Openeye Name: 2-(2-benzyloxy-2-oxo-ethyl)-2-(6-ethoxyhexyl)-3-methylene-butanedioate CAS Name: 2-(6-ethoxyhexyl)-3-methylene-2-(2-oxo-2-phenylmethoxyethyl)butanedioate IUPAC Name: 2-(6-ethoxyhexyl)-3-methylidene-2-(2-oxo-2-phenylmethoxyethyl)butanedioate Traditional Name: 2-(2-benzoxy-2-keto-ethyl)-2-(6-ethoxyhexyl)-3-methylene-succinate Formula: C22H28O7-2 MolecularWeight: 404.45352

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCCCCC(CC(=O)OCC1=CC=CC=C1)(C(=C)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCOCCCCCCC(CC(=O)OCC1=CC=CC=C1)(C(=C)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H30O7/c1-3-28-14-10-5-4-9-13-22(21(26)27,17(2)20(24)25)15-19(23)29-16-18-11-7-6-8-12-18/h6-8,11-12H,2-5,9-10,13-16H2,1H3,(H,24,25)(H,26,27)/p-2