Compound Identification
SMILES
NC1=CC2=C(C=C1)C=C(\C(=N/NC1=CC(=C(N\N=C3/C(=O)C4=C(C=C3S(O)(=O)=O)C=C(\C(=N\NC3=C(C=C(C=C3)[N+]([O-])=O)S(O)(=O)=O)C4=O)S(O)(=O)=O)C=C1)S(O)(=O)=O)C2=O)S(O)(=O)=O
InChIKey
InChIKey=TUWBZCUVSWNCEC-SGZZKVFXSA-N
Formula
C32H22N8O20S5
Mass
998.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
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Level 5
Naphthalene sulfonates
- Level 6 2-naphthalene sulfonates
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Level 5
Naphthalene sulfonates
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Subclass
Naphthalene sulfonic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Naphthalene sulfonates
Direct Parent
2-naphthalene sulfonates
Alternative Parents
2-naphthalene sulfonic acids and derivatives Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Nitrobenzenes Aryl ketones Phenylhydrazines Nitroaromatic compounds Sulfonyls Organosulfonic acids Organic oxoazanium compounds Hydrazones Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Organic salts Primary amines Organic oxides Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Benzenesulfonate - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Nitrobenzene - Benzenesulfonyl group - Aryl ketone - Phenylhydrazine - Nitroaromatic compound - Monocyclic benzene moiety - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Organic nitro compound - C-nitro compound - Ketone - Hydrazone - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Primary amine - Organic oxygen compound - Amine - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available