2,2-dibutyldecanedioate; ethyl ethanoate

Systemtic Name: 2,2-dibutyldecanedioate; ethyl ethanoate Openeye Name: 2,2-dibutyldecanedioate; ethyl acetate CAS Name: acetic acid ethyl ester; 2,2-dibutyldecanedioate IUPAC Name: 2,2-dibutyldecanedioate; ethyl acetate Traditional Name: acetic acid ethyl ester; 2,2-dibutylsebacate Formula: C22H40O6-2 MolecularWeight: 400.5494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CCCCCCCC(=O)[O-])C(=O)[O-].CCOC(=O)C

Isomeric SMILES

CCCCC(CCCC)(CCCCCCCC(=O)[O-])C(=O)[O-].CCOC(=O)C

InChI

InChI=1S/C18H34O4.C4H8O2/c1-3-5-13-18(17(21)22,14-6-4-2)15-11-9-7-8-10-12-16(19)20;1-3-6-4(2)5/h3-15H2,1-2H3,(H,19,20)(H,21,22);3H2,1-2H3/p-2