3,7,7-TRIMETHYL-1,4,7,8-TETRAHYDRO-5H-PYRAZOLO(4,3-D)(1,3)OXAZEPIN-5-ONE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H13N3O2
Molecular Weight	195.2184
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,7,7-TRIMETHYL-1,4,7,8-TETRAHYDRO-5H-PYRAZOLO(4,3-D)(1,3)OXAZEPIN-5-ONE

Structure Search

SMILES

CC1=NNC2=C1NC(=O)OC(C)(C)C2

InChI

InChIKey=WDDQQKDROQENFZ-UHFFFAOYSA-N

InChI=1S/C9H13N3O2/c1-5-7-6(12-11-5)4-9(2,3)14-8(13)10-7/h4H2,1-3H3,(H,10,13)(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C9H13N3O2
Molecular Weight	195.2184
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:51:54 GMT 2023` Edited by `admin` on `Sat Dec 16 12:51:54 GMT 2023`
Record UNII	03U2IMZ99K
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3,7,7-TRIMETHYL-1,4,7,8-TETRAHYDRO-5H-PYRAZOLO(4,3-D)(1,3)OXAZEPIN-5-ONE

Systematic Name

English

5H-PYRAZOLO(4,3-D)(1,3)OXAZEPIN-5-ONE, 1,4,7,8-TETRAHYDRO-3,7,7-TRIMETHYL-

Systematic Name

English

NSC-345654

Code

English

Code System Code Type Description

NSC

345654

Created by admin on Sat Dec 16 12:51:54 GMT 2023 , Edited by admin on Sat Dec 16 12:51:54 GMT 2023

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CAS

72499-52-6

Created by admin on Sat Dec 16 12:51:54 GMT 2023 , Edited by admin on Sat Dec 16 12:51:54 GMT 2023

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FDA UNII

03U2IMZ99K

Created by admin on Sat Dec 16 12:51:54 GMT 2023 , Edited by admin on Sat Dec 16 12:51:54 GMT 2023

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EPA CompTox

DTXSID90222794

Created by admin on Sat Dec 16 12:51:54 GMT 2023 , Edited by admin on Sat Dec 16 12:51:54 GMT 2023

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PUBCHEM

335532

Created by admin on Sat Dec 16 12:51:54 GMT 2023 , Edited by admin on Sat Dec 16 12:51:54 GMT 2023

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