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Details

Stereochemistry ACHIRAL
Molecular Formula C18H17N3O7S2
Molecular Weight 451.473
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 7-(2-(4-AMINO-2-METHOXY-5-METHYLPHENYL)DIAZENYL)-1,3-NAPHTHALENEDISULFONIC ACID

SMILES

COC1=CC(N)=C(C)C=C1\N=N\C2=CC=C3C=C(C=C(C3=C2)S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=QPRHJNURPQUWMK-QZQOTICOSA-N
InChI=1S/C18H17N3O7S2/c1-10-5-16(17(28-2)9-15(10)19)21-20-12-4-3-11-6-13(29(22,23)24)8-18(14(11)7-12)30(25,26)27/h3-9H,19H2,1-2H3,(H,22,23,24)(H,25,26,27)/b21-20+

HIDE SMILES / InChI

Molecular Formula C18H17N3O7S2
Molecular Weight 451.473
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:08:45 GMT 2023
Edited
by admin
on Sat Dec 16 12:08:45 GMT 2023
Record UNII
L7VT544ODU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-(2-(4-AMINO-2-METHOXY-5-METHYLPHENYL)DIAZENYL)-1,3-NAPHTHALENEDISULFONIC ACID
Systematic Name English
1,3-NAPHTHALENEDISULFONIC ACID, 7-((4-AMINO-2-METHOXY-5-METHYLPHENYL)AZO)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID6070273
Created by admin on Sat Dec 16 12:08:45 GMT 2023 , Edited by admin on Sat Dec 16 12:08:45 GMT 2023
PRIMARY
CAS
65168-14-1
Created by admin on Sat Dec 16 12:08:45 GMT 2023 , Edited by admin on Sat Dec 16 12:08:45 GMT 2023
PRIMARY
FDA UNII
L7VT544ODU
Created by admin on Sat Dec 16 12:08:45 GMT 2023 , Edited by admin on Sat Dec 16 12:08:45 GMT 2023
PRIMARY
ECHA (EC/EINECS)
265-589-0
Created by admin on Sat Dec 16 12:08:45 GMT 2023 , Edited by admin on Sat Dec 16 12:08:45 GMT 2023
PRIMARY