Compound Identification
SMILES
O=C(OC[C@@H]1[C@H]2CC(=O)O[C@H]2CN1OCC1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=ZKFVANLSBTUPBA-QRVBRYPASA-N
Formula
C21H21NO5
Mass
367.401
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Furopyrroles Benzoyl derivatives Gamma butyrolactones Pyrrolidines Pyrroles Oxolanes Furans Carboxylic acid esters Oxacyclic compounds N-organohydroxylamines Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzoyl - Furopyrrole - Gamma butyrolactone - Furan - Oxolane - Pyrrolidine - Pyrrole - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Oxacycle - Azacycle - N-organohydroxylamine - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available