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Details

Stereochemistry ACHIRAL
Molecular Formula C18H14N2O11S2
Molecular Weight 498.441
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,7-Naphthalenedisulfonic acid, 5-hydroxy-4-[[(3-nitrophenoxy)acetyl]amino]-

SMILES

OC1=C2C(NC(=O)COC3=CC=CC(=C3)[N+]([O-])=O)=CC=C(C2=CC(=C1)S(O)(=O)=O)S(O)(=O)=O

InChI

InChIKey=HGGGKLCVJHVTTC-UHFFFAOYSA-N
InChI=1S/C18H14N2O11S2/c21-15-8-12(32(25,26)27)7-13-16(33(28,29)30)5-4-14(18(13)15)19-17(22)9-31-11-3-1-2-10(6-11)20(23)24/h1-8,21H,9H2,(H,19,22)(H,25,26,27)(H,28,29,30)

HIDE SMILES / InChI

Approval Year

Name Type Language
1,7-Naphthalenedisulfonic acid, 5-hydroxy-4-[[(3-nitrophenoxy)acetyl]amino]-
Systematic Name English
1,7-Naphthalenedisulfonic acid, 5-hydroxy-4-[[2-(3-nitrophenoxy)acetyl]amino]-
Systematic Name English
5-Hydroxy-4-(((3-nitrophenoxy)acetyl)amino)naphthalene-1,7-disulphonic acid
Systematic Name English
5-Hydroxy-4-(((3-nitrophenoxy)acetyl)amino)naphthalene-1,7-disulfonic acid
Systematic Name English
5-Hydroxy-4-[[2-(3-nitrophenoxy)acetyl]amino]-1,7-naphthalenedisulfonic acid
Systematic Name English
Code System Code Type Description
FDA UNII
ASW3XW2BV2
Created by admin on Sat Dec 16 12:24:14 GMT 2023 , Edited by admin on Sat Dec 16 12:24:14 GMT 2023
PRIMARY
ECHA (EC/EINECS)
288-777-4
Created by admin on Sat Dec 16 12:24:14 GMT 2023 , Edited by admin on Sat Dec 16 12:24:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID10235205
Created by admin on Sat Dec 16 12:24:14 GMT 2023 , Edited by admin on Sat Dec 16 12:24:14 GMT 2023
PRIMARY
PUBCHEM
3021022
Created by admin on Sat Dec 16 12:24:14 GMT 2023 , Edited by admin on Sat Dec 16 12:24:14 GMT 2023
PRIMARY
CAS
85896-01-1
Created by admin on Sat Dec 16 12:24:14 GMT 2023 , Edited by admin on Sat Dec 16 12:24:14 GMT 2023
PRIMARY