MEPTYLDINOCAP

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H24N2O6
Molecular Weight	364.393
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of MEPTYLDINOCAP

Structure Search

SMILES

CCCCCCC(C)C1=C(OC(=O)\C=C\C)C(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=NIOPZPCMRQGZCE-WEVVVXLNSA-N

InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3/b9-5+

HIDE SMILES / InChI

Molecular Formula	C18H24N2O6
Molecular Weight	364.393
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:50:52 GMT 2025` Edited by `admin` on `Mon Mar 31 17:50:52 GMT 2025`
Record UNII	OQU8KLU91P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(±)-MEPTYLDINOCAP

Preferred Name

English

MEPTYLDINOCAP

Common Name

English

CROTONIC ACID, 2-(1-METHYLHEPTYL)-4,6-DINITROPHENYL ESTER, (E)-

Common Name

English

2,4-DNOPC

Common Name

English

MEPTYLDINOCAP, (±)-

Common Name

English

MEPTYLDINOCAP [ISO]

Common Name

English

2-BUTENOIC ACID, 2-(1-METHYLHEPTYL)-4,6-DINITROPHENYL ESTER, (E)-

Common Name

English

2-BUTENOIC ACID, 2-(1-METHYLHEPTYL)-4,6-DINITROPHENYL ESTER, (2E)-

Common Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

36000

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

Code System Code Type Description

FDA UNII

OQU8KLU91P

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

PRIMARY

MESH

C007500

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

PRIMARY

EPA CompTox

DTXSID90274056

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

PRIMARY

CAS

131-72-6

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

PRIMARY

ALANWOOD

meptyldinocap

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

PRIMARY

PUBCHEM

5284389

Created by admin on Mon Mar 31 17:50:52 GMT 2025 , Edited by admin on Mon Mar 31 17:50:52 GMT 2025

PRIMARY

Related Record Type Details


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2,4-DINITRO-6-(1-METHYLHEPTYL)PHENOL

METABOLITE -> PARENT

Amount: