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Details

Stereochemistry ACHIRAL
Molecular Formula C6H7N3O4
Molecular Weight 185.1375
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 2-NITROIMIDAZOLE-1-ACETATE

SMILES

COC(=O)CN1C=CN=C1[N+]([O-])=O

InChI

InChIKey=KXEHVMQCOHOQHB-UHFFFAOYSA-N
InChI=1S/C6H7N3O4/c1-13-5(10)4-8-3-2-7-6(8)9(11)12/h2-3H,4H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
METHYL 2-NITROIMIDAZOLE-1-ACETATE
Systematic Name English
NSC-302986
Code English
IMIDAZOLE-1-ACETIC ACID, 2-NITRO-, METHYL ESTER
Systematic Name English
1H-IMIDAZOLE-1-ACETIC ACID, 2-NITRO-, METHYL ESTER
Systematic Name English
METHYL 2-(2-NITRO-1H-IMIDAZOL-1-YL)ACETATE
Systematic Name English
Code System Code Type Description
PUBCHEM
89851
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
FDA UNII
Z3794V5PR2
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-243-5
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
CAS
22813-31-6
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID60177368
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY
NSC
302986
Created by admin on Sat Dec 16 12:28:06 GMT 2023 , Edited by admin on Sat Dec 16 12:28:06 GMT 2023
PRIMARY