Compound Identification
SMILES
CC1=CC(F)=C(NC(=O)C2=CSC=C2)C=C1NC1=CC2=C(C=C1)C(=O)C1=C(CO2)C=CC(OC[C@H]2COC(C)(C)O2)=C1
InChIKey
InChIKey=UBERNRJUAVCSQI-QHCPKHFHSA-N
Formula
C32H29FN2O6S
Mass
588.65
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzoxepines
- Subclass Dibenzoxepines
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Class
Benzoxepines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxepines
Subclass
Dibenzoxepines
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzoxepines
Alternative Parents
Aromatic anilides Diaminotoluenes Thiophene carboxamides Aniline and substituted anilines Aryl ketones Alkyl aryl ethers Ketals Fluorobenzenes Aryl fluorides 1,3-dioxolanes Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Oxacyclic compounds Secondary amines Organic oxides Organofluorides Organopnictogen compounds Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzoxepine - Aromatic anilide - Diaminotoluene - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Aryl ketone - Aniline or substituted anilines - Aminotoluene - Halobenzene - Fluorobenzene - Alkyl aryl ether - Toluene - Ketal - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Meta-dioxolane - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Ketone - Acetal - Secondary amine - Carboxylic acid derivative - Ether - Oxacycle - Organooxygen compound - Aldehyde - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzoxepines. These are compounds containing a dibenzoxepine moiety, which consists of two benzene connected by an oxazepine ring.
External Descriptors
Not available