chromium(3+); (9E,12E)-octadeca-9,12-dienoate; trichloride

Systemtic Name: chromium(3+); (9E,12E)-octadeca-9,12-dienoate; trichloride Openeye Name: dichromic (9E,12E)-octadeca-9,12-dienoate trichloride CAS Name: chromium(3+); (9E,12E)-octadeca-9,12-dienoate; trichloride IUPAC Name: chromium(3+); (9E,12E)-octadeca-9,12-dienoate; trichloride Traditional Name: dichromic (9E,12E)-octadeca-9,12-dienoate trichloride Formula: C54H93Cl3Cr2O6 MolecularWeight: 1048.66382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].CCCCCC=CCC=CCCCCCCCC(=O)[O-].[Cl-].[Cl-].[Cl-].[Cr+3].[Cr+3]

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].CCCCC/C=C/C/C=C/CCCCCCCC(=O)[O-].[Cl-].[Cl-].[Cl-].[Cr+3].[Cr+3]

InChI

InChI=1S/3C18H32O2.3ClH.2Cr/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;;;;/h3*6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);3*1H;;/q;;;;;;2*+3/p-6/b3*7-6+,10-9+;;;;;