Methyl 2-(octylideneamino)benzoate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H23NO2
Molecular Weight	261.3593
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of Methyl 2-(octylideneamino)benzoate

Structure Search

SMILES

CCCCCCCC=NC1=CC=CC=C1C(=O)OC

InChI

InChIKey=YHXKDPQWWGRLRC-GHRIWEEISA-N

InChI=1S/C16H23NO2/c1-3-4-5-6-7-10-13-17-15-12-9-8-11-14(15)16(18)19-2/h8-9,11-13H,3-7,10H2,1-2H3/b17-13+

HIDE SMILES / InChI

Molecular Formula	C16H23NO2
Molecular Weight	261.3593
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:48:46 GMT 2025` Edited by `admin` on `Mon Mar 31 21:48:46 GMT 2025`
Record UNII	8A36T93BX4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methyl 2-(octylideneamino)benzoate

Systematic Name

English

BENZOIC ACID, 2-(OCTYLIDENEAMINO)-, METHYL ESTER

Preferred Name

English

OCMEA

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID4070619

Created by admin on Mon Mar 31 21:48:46 GMT 2025 , Edited by admin on Mon Mar 31 21:48:46 GMT 2025

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CAS

67801-44-9

Created by admin on Mon Mar 31 21:48:46 GMT 2025 , Edited by admin on Mon Mar 31 21:48:46 GMT 2025

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PUBCHEM

105651

Created by admin on Mon Mar 31 21:48:46 GMT 2025 , Edited by admin on Mon Mar 31 21:48:46 GMT 2025

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ECHA (EC/EINECS)

267-165-0

Created by admin on Mon Mar 31 21:48:46 GMT 2025 , Edited by admin on Mon Mar 31 21:48:46 GMT 2025

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FDA UNII

8A36T93BX4

Created by admin on Mon Mar 31 21:48:46 GMT 2025 , Edited by admin on Mon Mar 31 21:48:46 GMT 2025

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