2-hexyl-3-methylidene-2-(2-oxidanylidene-2-phenoxy-ethyl)butanedioate

Systemtic Name: 2-hexyl-3-methylidene-2-(2-oxidanylidene-2-phenoxy-ethyl)butanedioate Openeye Name: 2-hexyl-3-methylene-2-(2-oxo-2-phenoxy-ethyl)butanedioate CAS Name: 2-hexyl-3-methylene-2-(2-oxo-2-phenoxyethyl)butanedioate IUPAC Name: 2-hexyl-3-methylidene-2-(2-oxo-2-phenoxyethyl)butanedioate Traditional Name: 2-hexyl-2-(2-keto-2-phenoxy-ethyl)-3-methylene-succinate Formula: C19H22O6-2 MolecularWeight: 346.37438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24O6/c1-3-4-5-9-12-19(18(23)24,14(2)17(21)22)13-16(20)25-15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,12-13H2,1H3,(H,21,22)(H,23,24)/p-2