U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18N2O2.HNO3
Molecular Weight 333.3392
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETONAM NITRATE, (S)-

SMILES

O[N+]([O-])=O.CCOC(=O)C1=CN=CN1[C@H]2CCCC3=C2C=CC=C3

InChI

InChIKey=UOEKCNNIZWEMHG-UQKRIMTDSA-N
InChI=1S/C16H18N2O2.HNO3/c1-2-20-16(19)15-10-17-11-18(15)14-9-5-7-12-6-3-4-8-13(12)14;2-1(3)4/h3-4,6,8,10-11,14H,2,5,7,9H2,1H3;(H,2,3,4)/t14-;/m0./s1

HIDE SMILES / InChI

Molecular Formula HNO3
Molecular Weight 63.0128
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C16H18N2O2
Molecular Weight 270.3263
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 11:26:57 GMT 2023
Edited
by admin
on Sat Dec 16 11:26:57 GMT 2023
Record UNII
184X69L6GW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETONAM NITRATE, (S)-
Common Name English
1H-IMIDAZOLE-5-CARBOXYLIC ACID, 1-(1,2,3,4-TETRAHYDRO-1-NAPHTHALENYL)-, ETHYL ESTER, NITRATE (1:1), (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
184X69L6GW
Created by admin on Sat Dec 16 11:26:57 GMT 2023 , Edited by admin on Sat Dec 16 11:26:57 GMT 2023
PRIMARY
PUBCHEM
76960126
Created by admin on Sat Dec 16 11:26:57 GMT 2023 , Edited by admin on Sat Dec 16 11:26:57 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER