Compound Identification
SMILES
CNCC1=CC(NC(=O)OC[C@H](C)C2=C(OC)C=C(C=C2)C(NC2=C(F)C=C3CNC(=O)C3=C2)C(O)=O)=CC=C1
InChIKey
InChIKey=IJEMMSZHSUMOMK-AJWVYOOVSA-N
Formula
C29H31FN4O6
Mass
550.587
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylcarbamic acid esters
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylcarbamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Phenylcarbamic acid esters
Alternative Parents
Bicyclic monoterpenoids Aromatic monoterpenoids Alpha amino acids Isoindolones Isoindoles Benzylamines Phenylmethylamines Phenoxy compounds Anisoles Methoxybenzenes Secondary alkylarylamines Alkyl aryl ethers Aralkylamines Aryl fluorides Carbamate esters Secondary carboxylic acid amides Amino acids Lactams Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Organofluorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylcarbamic acid ester - Isoindolone - Monoterpenoid - Bicyclic monoterpenoid - Aromatic monoterpenoid - P-cymene - Alpha-amino acid or derivatives - Alpha-amino acid - Isoindole - Isoindoline - Isoindole or derivatives - Methoxybenzene - Benzylamine - Phenylmethylamine - Anisole - Phenol ether - Phenoxy compound - Aralkylamine - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Aryl fluoride - Aryl halide - Carbamic acid ester - Amino acid or derivatives - Amino acid - Secondary carboxylic acid amide - Carboxamide group - Lactam - Ether - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Secondary amine - Organic nitrogen compound - Organic oxide - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.
External Descriptors
Not available