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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18N2O9S
Molecular Weight 474.4425
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(((4-((7-METHOXY-6-(SULFOOXY)-4-QUINOLINYL)OXY)PHENYL)AMINO)CARBONYL)CYCLOPROPANECARBOXYLIC ACID

SMILES

COc1cc2c(cc1OS(=O)(=O)O)c(ccn2)Oc3ccc(cc3)NC(=O)C4(CC4)C(=O)O

InChI

InChIKey=NGMVKHPJYUKGJR-UHFFFAOYSA-N
InChI=1S/C21H18N2O9S/c1-30-17-11-15-14(10-18(17)32-33(27,28)29)16(6-9-22-15)31-13-4-2-12(3-5-13)23-19(24)21(7-8-21)20(25)26/h2-6,9-11H,7-8H2,1H3,(H,23,24)(H,25,26)(H,27,28,29)

HIDE SMILES / InChI

Molecular Formula C21H18N2O9S
Molecular Weight 474.4425
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 Jun 26 07:27:40 UTC 2021
Edited
by admin
on Sat Jun 26 07:27:40 UTC 2021
Record UNII
NI7FZ38DO2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(((4-((7-METHOXY-6-(SULFOOXY)-4-QUINOLINYL)OXY)PHENYL)AMINO)CARBONYL)CYCLOPROPANECARBOXYLIC ACID
Systematic Name English
CABOZANTINIB METABOLITE M2A
Common Name English
EXEL-1644
Common Name English
CYCLOPROPANECARBOXYLIC ACID, 1-(((4-((7-METHOXY-6-(SULFOOXY)-4-QUINOLINYL)OXY)PHENYL)AMINO)CARBONYL)-
Systematic Name English
Code System Code Type Description
CAS
1628530-37-9
Created by admin on Sat Jun 26 07:27:40 UTC 2021 , Edited by admin on Sat Jun 26 07:27:40 UTC 2021
PRIMARY
FDA UNII
NI7FZ38DO2
Created by admin on Sat Jun 26 07:27:40 UTC 2021 , Edited by admin on Sat Jun 26 07:27:40 UTC 2021
PRIMARY
PUBCHEM
86269669
Created by admin on Sat Jun 26 07:27:40 UTC 2021 , Edited by admin on Sat Jun 26 07:27:40 UTC 2021
PRIMARY
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