Compound Identification
SMILES
COC1=CC(=CC(OC)=C1)C1=NC(SC2=C(C=C(C=O)C=C2)[N+]([O-])=O)=NN1
InChIKey
InChIKey=MZMGJYHWGXGONE-UHFFFAOYSA-N
Formula
C17H14N4O5S
Mass
386.38
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Nitrobenzenes
- Level 5 Nitrobenzaldehydes
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Subclass
Nitrobenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzaldehydes
Alternative Parents
Diarylthioethers Phenyl-1,2,4-triazoles Dimethoxybenzenes Anisoles Benzaldehydes Benzoyl derivatives Thiophenol ethers Nitroaromatic compounds Phenoxy compounds Alkyl aryl ethers Heteroaromatic compounds Azacyclic compounds Sulfenyl compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyltriazole - Phenyl-1,2,4-triazole - Diarylthioether - Nitrobenzaldehyde - Dimethoxybenzene - M-dimethoxybenzene - Anisole - Benzaldehyde - Benzoyl - Phenol ether - Thiophenol ether - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Methoxybenzene - Alkyl aryl ether - Aryl-aldehyde - Heteroaromatic compound - Triazole - 1,2,4-triazole - Azole - Organic nitro compound - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Ether - Organoheterocyclic compound - Organic oxoazanium - Thioether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organonitrogen compound - Aldehyde - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Organic salt - Organic zwitterion - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzaldehydes. These are nitrobenzenes that carry an aldehyde group at any position of the benzene ring.
External Descriptors
Not available