MK-0436

Details

Stereochemistry	MIXED
Molecular Formula	C11H14N4O3
Molecular Weight	250.2539
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C(=CN=C1C2=NOC3CCCCC23)[N+]([O-])=O

InChI

InChIKey=SPUUHYKZDFCYGW-UHFFFAOYSA-N

InChI=1S/C11H14N4O3/c1-14-9(15(16)17)6-12-11(14)10-7-4-2-3-5-8(7)18-13-10/h6-8H,2-5H2,1H3

HIDE SMILES / InChI

Molecular Formula	C11H14N4O3
Molecular Weight	250.2539
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:43:12 GMT 2025` Edited by `admin` on `Mon Mar 31 22:43:12 GMT 2025`
Record UNII	78LFE455SZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

J576.169G

Preferred Name

English

MK-0436

Common Name

English

1-METHYL-2-(3A,4,5,6,7,7A-HEXAHYDRO-1,2-BENZ-ISOXAZOL-3-YL)-5-NITROIMIDAZOLE

Systematic Name

English

3-(1-METHYL-5-NITROIMIDAZOL-2-YL)-3A,4,5,6,7,7A-HEXAHYDRO-1,2-BENZOXAZOLE

Systematic Name

English

1,2-BENZISOXAZOLE, 3A,4,5,6,7,7A-HEXAHYDRO-3-(1-METHYL-5-NITROIMIDAZOL-2-YL)-

Systematic Name

English

3-(1-METHYL-5-NITRO-1H-IMIDAZOL-2-YL)-3A,4,5,6,7,7A-HEXAHYDRO-1,2-BENZOXAZOLE

Systematic Name

English

1,2-BENZISOXAZOLE, 3A,4,5,6,7,7A-HEXAHYDRO-3-(1-METHYL-5-NITRO-1H-IMIDAZOL-2-YL)-

Systematic Name

English

3A,4,5,6,7,7A-HEXAHYDRO-3-(1-METHYL-5-NITRO-1H-IMIDAZOL-2-YL)-1,2-BENZISOXAZOLE

Systematic Name

English

Code System Code Type Description

CAS

33450-08-7

Created by admin on Mon Mar 31 22:43:12 GMT 2025 , Edited by admin on Mon Mar 31 22:43:12 GMT 2025

PRIMARY

EPA CompTox

DTXSID00874223

Created by admin on Mon Mar 31 22:43:12 GMT 2025 , Edited by admin on Mon Mar 31 22:43:12 GMT 2025

PRIMARY

FDA UNII

78LFE455SZ

Created by admin on Mon Mar 31 22:43:12 GMT 2025 , Edited by admin on Mon Mar 31 22:43:12 GMT 2025

PRIMARY

PUBCHEM

119263

Created by admin on Mon Mar 31 22:43:12 GMT 2025 , Edited by admin on Mon Mar 31 22:43:12 GMT 2025

PRIMARY