3-Nitrocoumarin

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H5NO4
Molecular Weight	191.1403
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[O-][N+](=O)C1=CC2=CC=CC=C2OC1=O

InChI

InChIKey=YTCVPEZECJYZRK-UHFFFAOYSA-N

InChI=1S/C9H5NO4/c11-9-7(10(12)13)5-6-3-1-2-4-8(6)14-9/h1-5H

HIDE SMILES / InChI

Molecular Formula	C9H5NO4
Molecular Weight	191.1403
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 15:20:53 GMT 2023` Edited by `admin` on `Sat Dec 16 15:20:53 GMT 2023`
Record UNII	UT6T82NTW8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Nitrocoumarin

Common Name

English

3-Nitro-2H-chromen-2-one

Systematic Name

English

3-Nitro-2H-1-benzopyran-2-one

Systematic Name

English

2H-1-Benzopyran-2-one, 3-nitro-

Systematic Name

English

Coumarin, 3-nitro-

Common Name

English

Code System Code Type Description

FDA UNII

UT6T82NTW8

Created by admin on Sat Dec 16 15:20:53 GMT 2023 , Edited by admin on Sat Dec 16 15:20:53 GMT 2023

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CAS

28448-04-6

Created by admin on Sat Dec 16 15:20:53 GMT 2023 , Edited by admin on Sat Dec 16 15:20:53 GMT 2023

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PUBCHEM

2799766

Created by admin on Sat Dec 16 15:20:53 GMT 2023 , Edited by admin on Sat Dec 16 15:20:53 GMT 2023

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EPA CompTox

DTXSID10384106

Created by admin on Sat Dec 16 15:20:53 GMT 2023 , Edited by admin on Sat Dec 16 15:20:53 GMT 2023

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