Compound Identification
SMILES
CCCC[N+]1=C(\C=C\C=C\C=C\C=C2/N(CCCCCC(O)=O)C3=C(C=C(C=C3)S(O)(=O)=O)C2(C)C)C(C)(C)C2=C1C=CC(=C2)[N+]([O-])=O
InChIKey
InChIKey=LZHWGCCQNDZCKF-UHFFFAOYSA-O
Formula
C37H46N3O7S
Mass
676.85
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Tertiary alkylarylamines Nitroaromatic compounds Medium-chain fatty acids Amino fatty acids Heterocyclic fatty acids Benzenoids Sulfonyls Organosulfonic acids Amino acids Organic oxoazanium compounds Azacyclic compounds Carboxylic acids Enamines Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organic salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Medium-chain fatty acid - Amino fatty acid - Heterocyclic fatty acid - Fatty acyl - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Organic nitro compound - Tertiary amine - Amino acid - Amino acid or derivatives - C-nitro compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enamine - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxide - Organosulfur compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available