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Details

Stereochemistry MIXED
Molecular Formula C14H21N3O6
Molecular Weight 327.333
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of 5-AMINO-N,N'-BIS(2,3-DIHYDROXYPROPYL)ISOPHTHALAMIDE

SMILES

NC1=CC(=CC(=C1)C(=O)NCC(O)CO)C(=O)NCC(O)CO

InChI

InChIKey=XOZGAPXHJKSZCU-UHFFFAOYSA-N
InChI=1S/C14H21N3O6/c15-10-2-8(13(22)16-4-11(20)6-18)1-9(3-10)14(23)17-5-12(21)7-19/h1-3,11-12,18-21H,4-7,15H2,(H,16,22)(H,17,23)

HIDE SMILES / InChI

Molecular Formula C14H21N3O6
Molecular Weight 327.333
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:26:59 GMT 2023
Edited
by admin
on Sat Dec 16 08:26:59 GMT 2023
Record UNII
ZLI7KW8WA3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-AMINO-N,N'-BIS(2,3-DIHYDROXYPROPYL)ISOPHTHALAMIDE
Systematic Name English
1,3-BENZENEDICARBOXAMIDE, 5-AMINO-N1,N3-BIS(2,3-DIHYDROXYPROPYL)-
Systematic Name English
5-AMINO-N,N'-BIS(2,3-DIHYDROXYPROPYL)ISOPHTHALDIAMIDE
Common Name English
Code System Code Type Description
CAS
76820-35-4
Created by admin on Sat Dec 16 08:26:59 GMT 2023 , Edited by admin on Sat Dec 16 08:26:59 GMT 2023
PRIMARY
PUBCHEM
2772121
Created by admin on Sat Dec 16 08:26:59 GMT 2023 , Edited by admin on Sat Dec 16 08:26:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID50998140
Created by admin on Sat Dec 16 08:26:59 GMT 2023 , Edited by admin on Sat Dec 16 08:26:59 GMT 2023
PRIMARY
FDA UNII
ZLI7KW8WA3
Created by admin on Sat Dec 16 08:26:59 GMT 2023 , Edited by admin on Sat Dec 16 08:26:59 GMT 2023
PRIMARY
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SALT/SOLVATE -> PARENT