2-(2-ethylhexyl)-3-methylidene-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]butanedioate

Systemtic Name: 2-(2-ethylhexyl)-3-methylidene-2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]butanedioate Openeye Name: 2-(2-ethylhexyl)-3-methylene-2-[2-oxo-2-(p-tolyl)ethyl]butanedioate CAS Name: 2-(2-ethylhexyl)-3-methylene-2-[2-(4-methylphenyl)-2-oxoethyl]butanedioate IUPAC Name: 2-(2-ethylhexyl)-3-methylidene-2-[2-(4-methylphenyl)-2-oxoethyl]butanedioate Traditional Name: 2-(2-ethylhexyl)-2-[2-keto-2-(p-tolyl)ethyl]-3-methylene-succinate Formula: C22H28O5-2 MolecularWeight: 372.45472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30O5/c1-5-7-8-17(6-2)13-22(21(26)27,16(4)20(24)25)14-19(23)18-11-9-15(3)10-12-18/h9-12,17H,4-8,13-14H2,1-3H3,(H,24,25)(H,26,27)/p-2