Compound Identification
SMILES
CC1=C(C=C(NC(=O)N(CC2=CC=C(C=C2)C(=O)NCC(F)(F)C(O)=O)C2=CC=C(C=C2)C2CCCCC2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=SDLCLNMUHMSFEJ-UHFFFAOYSA-N
Formula
C31H32F2N4O6
Mass
594.616
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Beta amino acids and derivatives
Alternative Parents
N-phenylureas Benzamides Nitrobenzenes Nitrotoluenes Benzoyl derivatives Nitroaromatic compounds Alpha-halocarboxylic acids Ureas Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxoazanium compounds Organonitrogen compounds Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic zwitterions Organic salts Organofluorides Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - N-phenylurea - Nitrobenzene - Benzamide - Nitrotoluene - Benzoic acid or derivatives - Nitroaromatic compound - Benzoyl - Toluene - Monocyclic benzene moiety - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - C-nitro compound - Urea - Secondary carboxylic acid amide - Carboxamide group - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic salt - Hydrocarbon derivative - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organic oxide - Organofluoride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available