Compound Identification
SMILES
CCOC(=O)N1CCC(CC1)NC(=O)C1(CCNCC1)NC(=O)C1=CC=C(O1)C1=C(C=C(Cl)C=C1)[N+]([O-])=O
InChIKey
InChIKey=JCTGRWFBOCHWNH-UHFFFAOYSA-N
Formula
C25H30ClN5O7
Mass
547.99
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Piperidinecarboxylic acids Piperidinecarboxamides Nitrobenzenes 2-heteroaryl carboxamides Furoic acid and derivatives Nitroaromatic compounds Chlorobenzenes Aryl chlorides Heteroaromatic compounds Carbamate esters Secondary carboxylic acid amides Organic oxoazanium compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Dialkylamines Azacyclic compounds Organic salts Organic oxides Organochlorides Hydrocarbon derivatives Carbonyl compounds Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Nitrobenzene - Piperidinecarboxamide - Piperidinecarboxylic acid - 2-heteroaryl carboxamide - Furoic acid or derivatives - Nitroaromatic compound - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Benzenoid - Carbamic acid ester - Heteroaromatic compound - Furan - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Secondary amine - Organoheterocyclic compound - Oxacycle - Organic 1,3-dipolar compound - Secondary aliphatic amine - Organic oxoazanium - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic salt - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available