E2M
cis-4-{[2-({4-[(1E)-3-morpholin-4-yl-3-oxoprop-1-en-1-yl]-2,3-bis(trifluoromethyl)phenyl}sulfanyl)phenoxy]methyl}cyclohexanecarboxylic acid
Find entries where: E2M
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | cis-4-{[2-({4-[(1E)-3-morpholin-4-yl-3-oxoprop-1-en-1-yl]-2,3-bis(trifluoromethyl)phenyl}sulfanyl)phenoxy]methyl}cyclohexanecarboxylic acid |
Identifiers | 4-[[2-[4-[(E)-3-morpholin-4-yl-3-oxo-prop-1-enyl]-2,3-bis(trifluoromethyl)phenyl]sulfanylphenoxy]methyl]cyclohexane-1-carboxylic acid |
Formula | C29 H29 F6 N O5 S |
Molecular Weight | 617.6 |
Type | NON-POLYMER |
Isomeric SMILES | c1ccc(c(c1)OCC2CCC(CC2)C(=O)O)Sc3ccc(c(c3C(F)(F)F)C(F)(F)F)\C=C\C(=O)N4CCOCC4 |
InChI | InChI=1S/C29H29F6NO5S/c30-28(31,32)25-19(10-12-24(37)36-13-15-40-16-14-36)9-11-23(26(25)29(33,34)35)42-22-4-2-1-3-21(22)41-17-18-5-7-20(8-6-18)27(38)39/h1-4,9-12,18,20H,5-8,13-17H2,(H,38,39)/b12-10+/t18-,20+ |
InChIKey | AXSOGTWJBSDWJQ-WZEPYWGYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 71 |
Chiral Atom Count | 0 |
Bond Count | 74 |
Aromatic Bond Count | 12 |