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Details

Stereochemistry ACHIRAL
Molecular Formula C19H25N3O4
Molecular Weight 359.4195
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-5-(3-(ISOPROPYLAMINO)-2,2-DIMETHYL-3-OXOPROPOXY)-2-METHYLQUINOLINE-3-CARBOXYLIC ACID

SMILES

CC(C)NC(=O)C(C)(C)COC1=CC=CC2=NC(C)=C(C(O)=O)C(N)=C12

InChI

InChIKey=RHXLOOCFQPJWBW-UHFFFAOYSA-N
InChI=1S/C19H25N3O4/c1-10(2)21-18(25)19(4,5)9-26-13-8-6-7-12-15(13)16(20)14(17(23)24)11(3)22-12/h6-8,10H,9H2,1-5H3,(H2,20,22)(H,21,25)(H,23,24)

HIDE SMILES / InChI

Molecular Formula C19H25N3O4
Molecular Weight 359.4195
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 20:19:59 GMT 2025
Edited
by admin
on Tue Apr 01 20:19:59 GMT 2025
Record UNII
QCE6H7E9VS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 4774
Preferred Name English
4-AMINO-5-(3-(ISOPROPYLAMINO)-2,2-DIMETHYL-3-OXOPROPOXY)-2-METHYLQUINOLINE-3-CARBOXYLIC ACID
Systematic Name English
3-QUINOLINECARBOXYLIC ACID, 4-AMINO-5-(2,2-DIMETHYL-3-((1-METHYLETHYL)AMINO)-3-OXOPROPOXY)-2-METHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID001019836
Created by admin on Tue Apr 01 20:19:59 GMT 2025 , Edited by admin on Tue Apr 01 20:19:59 GMT 2025
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FDA UNII
QCE6H7E9VS
Created by admin on Tue Apr 01 20:19:59 GMT 2025 , Edited by admin on Tue Apr 01 20:19:59 GMT 2025
PRIMARY
PUBCHEM
66746559
Created by admin on Tue Apr 01 20:19:59 GMT 2025 , Edited by admin on Tue Apr 01 20:19:59 GMT 2025
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CAS
1359963-68-0
Created by admin on Tue Apr 01 20:19:59 GMT 2025 , Edited by admin on Tue Apr 01 20:19:59 GMT 2025
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JECFA MONOGRAPH
2177
Created by admin on Tue Apr 01 20:19:59 GMT 2025 , Edited by admin on Tue Apr 01 20:19:59 GMT 2025
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JECFA MONOGRAPH
2184
Created by admin on Tue Apr 01 20:19:59 GMT 2025 , Edited by admin on Tue Apr 01 20:19:59 GMT 2025
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