3-ETHYLHEXAHYDRO-1-METHYL-3-(3-OXO-1-CYCLOHEXEN-1-YL)-2H-AZEPIN-2-ONE

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Details

Stereochemistry	RACEMIC
Molecular Formula	C15H23NO2
Molecular Weight	249.3486
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-ETHYLHEXAHYDRO-1-METHYL-3-(3-OXO-1-CYCLOHEXEN-1-YL)-2H-AZEPIN-2-ONE

Structure Search

SMILES

CCC1(CCCCN(C)C1=O)C2=CC(=O)CCC2

InChI

InChIKey=PHWHMJKWJICNLX-UHFFFAOYSA-N

InChI=1S/C15H23NO2/c1-3-15(12-7-6-8-13(17)11-12)9-4-5-10-16(2)14(15)18/h11H,3-10H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C15H23NO2
Molecular Weight	249.3486
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:26:40 GMT 2023` Edited by `admin` on `Sat Dec 16 11:26:41 GMT 2023`
Record UNII	YL5SY12PGM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-ETHYLHEXAHYDRO-1-METHYL-3-(3-OXO-1-CYCLOHEXEN-1-YL)-2H-AZEPIN-2-ONE

Systematic Name

English

2H-AZEPIN-2-ONE, 3-ETHYLHEXAHYDRO-1-METHYL-3-(3-OXO-1-CYCLOHEXEN-1-YL)-

Systematic Name

English

Code System Code Type Description

CAS

71556-77-9

Created by admin on Sat Dec 16 11:26:41 GMT 2023 , Edited by admin on Sat Dec 16 11:26:41 GMT 2023

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EPA CompTox

DTXSID60992114

Created by admin on Sat Dec 16 11:26:41 GMT 2023 , Edited by admin on Sat Dec 16 11:26:41 GMT 2023

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PUBCHEM

11970585

Created by admin on Sat Dec 16 11:26:41 GMT 2023 , Edited by admin on Sat Dec 16 11:26:41 GMT 2023

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ECHA (EC/EINECS)

275-623-6

Created by admin on Sat Dec 16 11:26:41 GMT 2023 , Edited by admin on Sat Dec 16 11:26:41 GMT 2023

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FDA UNII

YL5SY12PGM

Created by admin on Sat Dec 16 11:26:41 GMT 2023 , Edited by admin on Sat Dec 16 11:26:41 GMT 2023

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