Compound Identification
SMILES
COC1=C(OC)C=C(CO[C@@H]2C[C@@H](CC\C(Cl)=C\C\C=C(\C)COC(=O)C3=CC=C(C=C3)[N+]([O-])=O)O[C@H]2[C@H]2COC(C)(C)O2)C=C1
InChIKey
InChIKey=UWGWDOXPEXKISE-MEOLLPLPSA-N
Formula
C34H42ClNO10
Mass
660.16
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- 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
Nitrobenzoic acids and derivatives
Alternative Parents
C-glycosyl compounds Benzoic acid esters Dimethoxybenzenes Benzylethers Nitrobenzenes Phenoxy compounds Anisoles Benzoyl derivatives Nitroaromatic compounds Alkyl aryl ethers Ketals Monosaccharides 1,3-dioxolanes Oxolanes Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxoazanium compounds Dialkyl ethers Chloroalkenes Vinyl chlorides Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic salts Organochlorides Organonitrogen compounds Organopnictogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzoate - Glycosyl compound - C-glycosyl compound - Dimethoxybenzene - O-dimethoxybenzene - Benzoate ester - Benzylether - Nitrobenzene - Benzoyl - Nitroaromatic compound - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Ketal - Monosaccharide - Meta-dioxolane - Oxolane - Organic nitro compound - C-nitro compound - Carboxylic acid ester - Vinyl chloride - Propargyl-type 1,3-dipolar organic compound - Acetal - Oxacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Dialkyl ether - Organoheterocyclic compound - Haloalkene - Ether - Chloroalkene - Vinyl halide - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzoic acids and derivatives. These are compounds containing a nitrobenzoic acid moiety, which consists of a benzene ring bearing both a carboxylic acid group and a nitro group on two different ring carbon atoms.
External Descriptors
Not available