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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18N2O3
Molecular Weight 286.3257
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[[2-(4-Nitrophenyl)-ethyl]amino]-1-phenylethanol, (R)-

SMILES

O[C@@H](CNCCC1=CC=C(C=C1)[N+]([O-])=O)C2=CC=CC=C2

InChI

InChIKey=GXTZAIGFWQRDSQ-INIZCTEOSA-N
InChI=1S/C16H18N2O3/c19-16(14-4-2-1-3-5-14)12-17-11-10-13-6-8-15(9-7-13)18(20)21/h1-9,16-17,19H,10-12H2/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H18N2O3
Molecular Weight 286.3257
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:32:39 UTC 2023
Edited
by admin
on Sat Dec 16 18:32:39 UTC 2023
Record UNII
S5WN6RQZ9B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[[2-(4-Nitrophenyl)-ethyl]amino]-1-phenylethanol, (R)-
Common Name English
Benzenemethanol, α-[[[2-(4-nitrophenyl)ethyl]amino]methyl]-, (αR)-
Systematic Name English
(R)-2-((4-NITROPHENETHYL)AMINO)-1-PHENYLETHAN-1-OL
Systematic Name English
(1R)-2-[2-(4-Nitrophenyl)ethylamino]-1-phenylethano
Systematic Name English
(1R)-2-[[2-(4-Nitrophenyl)ethyl]amino]-1-phenylethanol
Systematic Name English
2-(4-Nitrophenethylamino)-1-phenylethanol, (R)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00673056
Created by admin on Sat Dec 16 18:32:39 UTC 2023 , Edited by admin on Sat Dec 16 18:32:39 UTC 2023
PRIMARY
PUBCHEM
46193352
Created by admin on Sat Dec 16 18:32:39 UTC 2023 , Edited by admin on Sat Dec 16 18:32:39 UTC 2023
PRIMARY
FDA UNII
S5WN6RQZ9B
Created by admin on Sat Dec 16 18:32:39 UTC 2023 , Edited by admin on Sat Dec 16 18:32:39 UTC 2023
PRIMARY
CAS
223673-34-5
Created by admin on Sat Dec 16 18:32:39 UTC 2023 , Edited by admin on Sat Dec 16 18:32:39 UTC 2023
PRIMARY
Related Record Type Details
IMPURITY -> PARENT