AC9
Summary
Name: | TRISACETYLACETONATOCHROMIUM(III) |
Formula: | C15 H21 Cr O6 |
Formal charge: | 0 |
Formula weight: | 349.32 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2,4,8,10,13,15-hexamethyl-1,5$l^{3},7,11$l^{3},12,16$l^{3}-hexaoxa-6$l^{6}-chromaspiro[5.5^{6}.5^{6}]hexadeca-2,4,8,10,13,15-hexaene |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/3C5H8O2.Cr/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3/b3*4-3-; |
InChIKey | InChI | 1.06 | JWORPXLMBPOPPU-LNTINUHCSA-K |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)C=C(C)O[Cr](OC(=CC(=O)C)C)OC(=CC(=O)C)C |
SMILES | CACTVS | 3.385 | CC(=O)C=C(C)O[Cr](OC(=CC(=O)C)C)OC(=CC(=O)C)C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC1=CC(=O[Cr]23(O1)(OC(=CC(=O2)C)C)OC(=CC(=O3)C)C)C |
SMILES | OpenEye OEToolkits | 2.0.7 | CC1=CC(=O[Cr]23(O1)(OC(=CC(=O2)C)C)OC(=CC(=O3)C)C)C |