Compound Identification
SMILES
OC(=O)C(F)(F)F.CCN1CC2(CC1=O)CN(Cc1ccco1)CCN(C2)C(=O)C(C)C
InChIKey
InChIKey=KJVZISZNPYCFQK-UHFFFAOYSA-N
Formula
C21H30F3N3O5
Mass
461.482
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazepanes
- Subclass 1,4-diazepanes
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Class
Diazepanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazepanes
Subclass
1,4-diazepanes
Intermediate Tree Nodes
Not available
Direct Parent
1,4-diazepanes
Alternative Parents
Aralkylamines Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Furans Trialkylamines Amino acids and derivatives Lactams Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds Alkyl fluorides
Molecular Framework
Not available
Substituents
1,4-diazepane - Aralkylamine - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Furan - Pyrrolidine - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Lactam - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organopnictogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-diazepanes. These are diazepanes having the two nitrogen atoms at position 1 and 4 of the diazepane ring.
External Descriptors
Not available