cerium(3+); 2-hexyldodecanedioate

Systemtic Name: cerium(3+); 2-hexyldodecanedioate Openeye Name: cerium(3+); 2-hexyldodecanedioate CAS Name: cerium(3+); 2-hexyldodecanedioate IUPAC Name: cerium(3+); 2-hexyldodecanedioate Traditional Name: cerium(3+); 2-hexyldodecanedioate Formula: C54H96Ce2O12 MolecularWeight: 1217.56484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)[O-].CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)[O-].CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)[O-].[Ce+3].[Ce+3]

Isomeric SMILES

CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)[O-].CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)[O-].CCCCCCC(CCCCCCCCCC(=O)[O-])C(=O)[O-].[Ce+3].[Ce+3]

InChI

InChI=1S/3C18H34O4.2Ce/c3*1-2-3-4-10-13-16(18(21)22)14-11-8-6-5-7-9-12-15-17(19)20;;/h3*16H,2-15H2,1H3,(H,19,20)(H,21,22);;/q;;;2*+3/p-6