2,2-bis(prop-2-enyl)propanedioate; butane; 2-butyl-2-methyl-propanedioate

Systemtic Name: 2,2-bis(prop-2-enyl)propanedioate; butane; 2-butyl-2-methyl-propanedioate Openeye Name: butane; 2-butyl-2-methyl-propanedioate; 2,2-diallylpropanedioate CAS Name: 2,2-bis(prop-2-enyl)propanedioate; butane; 2-butyl-2-methylpropanedioate IUPAC Name: 2,2-bis(prop-2-enyl)propanedioate; butane; 2-butyl-2-methylpropanedioate Traditional Name: 2-butyl-2-methyl-malonate; 2,2-diallylmalonate; n-butane Formula: C25H42O8-4 MolecularWeight: 470.59618

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCC.CCCCC(C)(C(=O)[O-])C(=O)[O-].C=CCC(CC=C)(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCC.CCCC.CCCCC(C)(C(=O)[O-])C(=O)[O-].C=CCC(CC=C)(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C9H12O4.C8H14O4.2C4H10/c1-3-5-9(6-4-2,7(10)11)8(12)13;1-3-4-5-8(2,6(9)10)7(11)12;2*1-3-4-2/h3-4H,1-2,5-6H2,(H,10,11)(H,12,13);3-5H2,1-2H3,(H,9,10)(H,11,12);2*3-4H2,1-2H3/p-4