sodium 2-carboxy-1-[3-[2-(2,3-dimethylbut-2-enoyloxy)ethoxy]-2,2-dimethyl-3-oxidanylidene-propyl]-2-ethyl-cyclopropane-1-carboxylate

Systemtic Name: sodium 2-carboxy-1-[3-[2-(2,3-dimethylbut-2-enoyloxy)ethoxy]-2,2-dimethyl-3-oxidanylidene-propyl]-2-ethyl-cyclopropane-1-carboxylate Openeye Name: sodium 2-carboxy-1-[3-[2-(2,3-dimethylbut-2-enoyloxy)ethoxy]-2,2-dimethyl-3-oxo-propyl]-2-ethyl-cyclopropanecarboxylate CAS Name: sodium 2-carboxy-1-[3-[2-(2,3-dimethyl-1-oxobut-2-enoxy)ethoxy]-2,2-dimethyl-3-oxopropyl]-2-ethyl-1-cyclopropanecarboxylate IUPAC Name: sodium 2-carboxy-1-[3-[2-(2,3-dimethylbut-2-enoyloxy)ethoxy]-2,2-dimethyl-3-oxopropyl]-2-ethylcyclopropane-1-carboxylate Traditional Name: sodium 2-carboxy-1-[3-[2-(2,3-dimethylbut-2-enoyloxy)ethoxy]-3-keto-2,2-dimethyl-propyl]-2-ethyl-cyclopropanecarboxylate Formula: C20H29NaO8 MolecularWeight: 420.42923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC1(CC(C)(C)C(=O)OCCOC(=O)C(=C(C)C)C)C(=O)[O-])C(=O)O.[Na+]

Isomeric SMILES

CCC1(CC1(CC(C)(C)C(=O)OCCOC(=O)C(=C(C)C)C)C(=O)[O-])C(=O)O.[Na+]

InChI

InChI=1S/C20H30O8.Na/c1-7-19(15(22)23)11-20(19,16(24)25)10-18(5,6)17(26)28-9-8-27-14(21)13(4)12(2)3;/h7-11H2,1-6H3,(H,22,23)(H,24,25);/q;+1/p-1