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

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H9N3O2
Molecular Weight	167.1653
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

CC1=NNC2=C1NC(=O)OCC2

InChI

InChIKey=KMBUBFZYSQSCDL-UHFFFAOYSA-N

InChI=1S/C7H9N3O2/c1-4-6-5(10-9-4)2-3-12-7(11)8-6/h2-3H2,1H3,(H,8,11)(H,9,10)

HIDE SMILES / InChI

Molecular Formula	C7H9N3O2
Molecular Weight	167.1653
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 `Tue Apr 01 20:13:40 GMT 2025` Edited by `admin` on `Tue Apr 01 20:13:40 GMT 2025`
Record UNII	O68CPJ610T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-345652

Preferred Name

English

3-METHYL-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-METHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30222793

Created by admin on Tue Apr 01 20:13:40 GMT 2025 , Edited by admin on Tue Apr 01 20:13:40 GMT 2025

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FDA UNII

O68CPJ610T

Created by admin on Tue Apr 01 20:13:40 GMT 2025 , Edited by admin on Tue Apr 01 20:13:40 GMT 2025

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PUBCHEM

335530

Created by admin on Tue Apr 01 20:13:40 GMT 2025 , Edited by admin on Tue Apr 01 20:13:40 GMT 2025

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NSC

345652

Created by admin on Tue Apr 01 20:13:40 GMT 2025 , Edited by admin on Tue Apr 01 20:13:40 GMT 2025

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CAS

72499-50-4

Created by admin on Tue Apr 01 20:13:40 GMT 2025 , Edited by admin on Tue Apr 01 20:13:40 GMT 2025

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