VALERANILIDE, 3'-HYDROXY-, METHYLCARBAMATE (ESTER)

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H18N2O3
Molecular Weight	250.2936
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of VALERANILIDE, 3'-HYDROXY-, METHYLCARBAMATE (ESTER)

Structure Search

SMILES

CCCCC(=O)NC1=CC=CC(OC(=O)NC)=C1

InChI

InChIKey=JRMUCETZFNOFMW-UHFFFAOYSA-N

InChI=1S/C13H18N2O3/c1-3-4-8-12(16)15-10-6-5-7-11(9-10)18-13(17)14-2/h5-7,9H,3-4,8H2,1-2H3,(H,14,17)(H,15,16)

HIDE SMILES / InChI

Molecular Formula	C13H18N2O3
Molecular Weight	250.2936
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 12:44:34 GMT 2023` Edited by `admin` on `Sat Dec 16 12:44:34 GMT 2023`
Record UNII	KA7OOJ1OBW
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VALERANILIDE, 3'-HYDROXY-, METHYLCARBAMATE (ESTER)

Systematic Name

English

NSC-222515

Code

English

CARBAMIC ACID, METHYL-, ESTER WITH 3'-HYDROXYVALERANILIDE

Systematic Name

English

PENTANAMIDE, N-(3-(((METHYLAMINO)CARBONYL)OXY)PHENYL)-

Systematic Name

English

Code System Code Type Description

NSC

222515

Created by admin on Sat Dec 16 12:44:34 GMT 2023 , Edited by admin on Sat Dec 16 12:44:34 GMT 2023

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EPA CompTox

DTXSID90170428

Created by admin on Sat Dec 16 12:44:34 GMT 2023 , Edited by admin on Sat Dec 16 12:44:34 GMT 2023

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CAS

17814-28-7

Created by admin on Sat Dec 16 12:44:34 GMT 2023 , Edited by admin on Sat Dec 16 12:44:34 GMT 2023

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FDA UNII

KA7OOJ1OBW

Created by admin on Sat Dec 16 12:44:34 GMT 2023 , Edited by admin on Sat Dec 16 12:44:34 GMT 2023

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PUBCHEM

99423

Created by admin on Sat Dec 16 12:44:34 GMT 2023 , Edited by admin on Sat Dec 16 12:44:34 GMT 2023

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