Structure Database (LMSD)
Common Name
1-(4-carboxybutanamido)-1'-(dimethylcarbamoyl)ferrocene
Systematic Name
{(1,2,3,4,5-eta)-1-(4-carboxybutanamido)cyclopentadienyl}[(1,2,3,4,5-eta)-1-(dimethylcarbamoyl)cyclopentadienyl]iron
Synonyms
- 1-[(4-carboxy-1-oxobutyl)amino]-1'-[(dimethylamino)carbonyl]ferrocene
- 1-[(4-carboxybutanoyl)amino]-1'-[(dimethylamino)carbonyl]ferrocene
LM ID
LMFA08020163
Formula
C18H22N2O4Fe
Exact Mass
Calculate m/z
386.092897
Status
Active
3D model of 1-(4-carboxybutanamido)-1'-(dimethylcarbamoyl)ferrocene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
NLQYMKZSSTTWRO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H12NO3.C8H10NO.Fe/c12-9(6-3-7-10(13)14)11-8-4-1-2-5-8;1-9(2)8(10)7-5-3-4-6-7;/h1-2,4-5H,3,6-7H2,(H,11,12)(H,13,14);3-6H,1-2H3;
SMILES (Click to copy)
C12[Fe]3456789(C%10C3C4C5(C(N(C)C)=O)C6%10)C(C7C18)C29NC(=O)CCCC(=O)O
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Created at
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Updated at
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