Compound Identification
SMILES
CCN(C1CCN(CCC2=CC=CC=C2)CC1)C(=O)[C@@H]1CCCN1S(=O)(=O)C1=CC2=C(C=C1)C(Cl)=CC=C2
InChIKey
InChIKey=XNOFLDGSSUCALL-LJAQVGFWSA-N
Formula
C30H36ClN3O3S
Mass
554.15
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
2-naphthalene sulfonic acids and derivatives
Alternative Parents
2-naphthalene sulfonamides Proline and derivatives Alpha amino acid amides Chloronaphthalenes Phenethylamines Pyrrolidinecarboxamides Aralkylamines Piperidines Organosulfonamides Aryl chlorides Tertiary carboxylic acid amides Sulfonyls Trialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - 2-naphthalene sulfonamide - Proline or derivatives - Alpha-amino acid amide - Chloronaphthalene - Alpha-amino acid or derivatives - Phenethylamine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Organosulfonic acid amide - Tertiary carboxylic acid amide - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Amino acid or derivatives - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available