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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H18N2O9
Molecular Weight 394.3328
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NMI-1182

SMILES

COC1=CC2=CC=C(C=C2C=C1)[C@H](C)C(=O)OC[C@H](CO[N+]([O-])=O)O[N+]([O-])=O

InChI

InChIKey=DHMLCNFGWGUOSW-MEDUHNTESA-N
InChI=1S/C17H18N2O9/c1-11(12-3-4-14-8-15(25-2)6-5-13(14)7-12)17(20)26-9-16(28-19(23)24)10-27-18(21)22/h3-8,11,16H,9-10H2,1-2H3/t11-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H18N2O9
Molecular Weight 394.3328
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:57:12 GMT 2023
Edited
by admin
on Sat Dec 16 18:57:12 GMT 2023
Record UNII
A4XM3U43MN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NMI-1182
Common Name English
2-NAPHTHALENEACETIC ACID, 6-METHOXY-.ALPHA.-METHYL-, (2R)-2,3-BIS(NITROOXY)PROPYL ESTER, (.ALPHA.S)-
Systematic Name English
(2R)-2,3-BIS(NITROOXY)PROPYL (2S)-2-(6-METHOXY-2-NAPHTHYL)PROPANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
A4XM3U43MN
Created by admin on Sat Dec 16 18:57:12 GMT 2023 , Edited by admin on Sat Dec 16 18:57:12 GMT 2023
PRIMARY
PUBCHEM
10250021
Created by admin on Sat Dec 16 18:57:12 GMT 2023 , Edited by admin on Sat Dec 16 18:57:12 GMT 2023
PRIMARY
CAS
646509-43-5
Created by admin on Sat Dec 16 18:57:12 GMT 2023 , Edited by admin on Sat Dec 16 18:57:12 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY