2-(2-hexoxyethyl)-3-methylidene-2-[2-(3-methylphenoxy)-2-oxidanylidene-ethyl]butanedioate

Systemtic Name: 2-(2-hexoxyethyl)-3-methylidene-2-[2-(3-methylphenoxy)-2-oxidanylidene-ethyl]butanedioate Openeye Name: 2-(2-hexoxyethyl)-3-methylene-2-[2-(3-methylphenoxy)-2-oxo-ethyl]butanedioate CAS Name: 2-(2-hexoxyethyl)-3-methylene-2-[2-(3-methylphenoxy)-2-oxoethyl]butanedioate IUPAC Name: 2-(2-hexoxyethyl)-3-methylidene-2-[2-(3-methylphenoxy)-2-oxoethyl]butanedioate Traditional Name: 2-(2-hexoxyethyl)-2-[2-keto-2-(3-methylphenoxy)ethyl]-3-methylene-succinate Formula: C22H28O7-2 MolecularWeight: 404.45352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCC(CC(=O)OC1=CC=CC(=C1)C)(C(=C)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCCOCCC(CC(=O)OC1=CC=CC(=C1)C)(C(=C)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H30O7/c1-4-5-6-7-12-28-13-11-22(21(26)27,17(3)20(24)25)15-19(23)29-18-10-8-9-16(2)14-18/h8-10,14H,3-7,11-13,15H2,1-2H3,(H,24,25)(H,26,27)/p-2