NIA-11637

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H17NO3
Molecular Weight	235.279
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CNC(=O)OC1=C2OC(C)(C)CCC2=CC=C1

InChI

InChIKey=XAMLYVOKCFEFDG-UHFFFAOYSA-N

InChI=1S/C13H17NO3/c1-13(2)8-7-9-5-4-6-10(11(9)17-13)16-12(15)14-3/h4-6H,7-8H2,1-3H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C13H17NO3
Molecular Weight	235.279
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 12:45:23 GMT 2023` Edited by `admin` on `Sat Dec 16 12:45:23 GMT 2023`
Record UNII	IYD478G664
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NIA-11637

Common Name

English

8-CHROMANOL, 2,2-DIMETHYL-, METHYLCARBAMATE

Systematic Name

English

CARBAMIC ACID, METHYL-, 2,2-DIMETHYL-8-CHROMANYL ESTER

Systematic Name

English

2,2-DIMETHYLCHROMANYL-8 N-METHYLCARBAMATE

Common Name

English

2H-1-BENZOPYRAN-8-OL, 3,4-DIHYDRO-2,2-DIMETHYL-, 8-(N-METHYLCARBAMATE)

Systematic Name

English

2H-1-BENZOPYRAN-8-OL, 3,4-DIHYDRO-2,2-DIMETHYL-, METHYLCARBAMATE

Systematic Name

English

Code System Code Type Description

FDA UNII

IYD478G664

Created by admin on Sat Dec 16 12:45:23 GMT 2023 , Edited by admin on Sat Dec 16 12:45:23 GMT 2023

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EPA CompTox

DTXSID90167156

Created by admin on Sat Dec 16 12:45:23 GMT 2023 , Edited by admin on Sat Dec 16 12:45:23 GMT 2023

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CAS

16146-62-6

Created by admin on Sat Dec 16 12:45:23 GMT 2023 , Edited by admin on Sat Dec 16 12:45:23 GMT 2023

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PUBCHEM

27703

Created by admin on Sat Dec 16 12:45:23 GMT 2023 , Edited by admin on Sat Dec 16 12:45:23 GMT 2023

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Related Record Type Details


					IYD478G664

NIA-11637

ACTIVE MOIETY