Isopropyl 3-amino-4-methylbenzoate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H15NO2
Molecular Weight	193.2423
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Isopropyl 3-amino-4-methylbenzoate

Structure Search

SMILES

CC(C)OC(=O)C1=CC=C(C)C(N)=C1

InChI

InChIKey=NQIWSFLRVNIRJU-UHFFFAOYSA-N

InChI=1S/C11H15NO2/c1-7(2)14-11(13)9-5-4-8(3)10(12)6-9/h4-7H,12H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C11H15NO2
Molecular Weight	193.2423
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 `Tue Apr 01 19:10:05 GMT 2025` Edited by `admin` on `Tue Apr 01 19:10:05 GMT 2025`
Record UNII	ZSB7PA8JTS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isopropyl 3-amino-4-methylbenzoate

Systematic Name

English

1-Methylethyl 3-amino-4-methylbenzoate

Preferred Name

English

Benzoic acid, 3-amino-4-methyl-, 1-methylethyl ester

Systematic Name

English

Code System Code Type Description

CAS

21447-47-2

Created by admin on Tue Apr 01 19:10:05 GMT 2025 , Edited by admin on Tue Apr 01 19:10:05 GMT 2025

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FDA UNII

ZSB7PA8JTS

Created by admin on Tue Apr 01 19:10:05 GMT 2025 , Edited by admin on Tue Apr 01 19:10:05 GMT 2025

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PUBCHEM

88907

Created by admin on Tue Apr 01 19:10:05 GMT 2025 , Edited by admin on Tue Apr 01 19:10:05 GMT 2025

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EPA CompTox

DTXSID20175724

Created by admin on Tue Apr 01 19:10:05 GMT 2025 , Edited by admin on Tue Apr 01 19:10:05 GMT 2025

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ECHA (EC/EINECS)

244-393-9

Created by admin on Tue Apr 01 19:10:05 GMT 2025 , Edited by admin on Tue Apr 01 19:10:05 GMT 2025

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