O-NITROBENZYLBENZOATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H11NO4
Molecular Weight	257.2414
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[O-][N+](=O)C1=CC=CC=C1COC(=O)C2=CC=CC=C2

InChI

InChIKey=IFNWVKHDWYPTRH-UHFFFAOYSA-N

InChI=1S/C14H11NO4/c16-14(11-6-2-1-3-7-11)19-10-12-8-4-5-9-13(12)15(17)18/h1-9H,10H2

HIDE SMILES / InChI

Molecular Formula	C14H11NO4
Molecular Weight	257.2414
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 `Mon Mar 31 21:04:48 GMT 2025` Edited by `admin` on `Mon Mar 31 21:04:48 GMT 2025`
Record UNII	I88OOH313Y
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

O-NITROBENZYLBENZOATE

Common Name

English

BENZENEMETHANOL, 2-NITRO-, BENZOATE (ESTER)

Preferred Name

English

BENZENEMETHANOL, 2-NITRO-, 1-BENZOATE

Systematic Name

English

2-NITROBENZYL BENZOATE

Systematic Name

English

O-NITROBENZYL BENZOATE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID90149391

Created by admin on Mon Mar 31 21:04:48 GMT 2025 , Edited by admin on Mon Mar 31 21:04:48 GMT 2025

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CAS

110786-18-0

Created by admin on Mon Mar 31 21:04:48 GMT 2025 , Edited by admin on Mon Mar 31 21:04:48 GMT 2025

PRIMARY

PUBCHEM

135722

Created by admin on Mon Mar 31 21:04:48 GMT 2025 , Edited by admin on Mon Mar 31 21:04:48 GMT 2025

PRIMARY

FDA UNII

I88OOH313Y

Created by admin on Mon Mar 31 21:04:48 GMT 2025 , Edited by admin on Mon Mar 31 21:04:48 GMT 2025

PRIMARY