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Details

Stereochemistry ACHIRAL
Molecular Formula C36H51N3
Molecular Weight 525.8102
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.,.ALPHA.-BIS(2-(BIS(3-METHYL-2-BUTEN-1-YL)AMINO)ETHYL)-1-NAPHTHALENEACETONITRILE

SMILES

CC(C)=CCN(CCC(CCN(CC=C(C)C)CC=C(C)C)(C#N)C1=C2C=CC=CC2=CC=C1)CC=C(C)C

InChI

InChIKey=DDWKCBUSQTZBMR-UHFFFAOYSA-N
InChI=1S/C36H51N3/c1-29(2)16-22-38(23-17-30(3)4)26-20-36(28-37,35-15-11-13-33-12-9-10-14-34(33)35)21-27-39(24-18-31(5)6)25-19-32(7)8/h9-19H,20-27H2,1-8H3

HIDE SMILES / InChI

Molecular Formula C36H51N3
Molecular Weight 525.8102
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 19:35:52 GMT 2025
Edited
by admin
on Tue Apr 01 19:35:52 GMT 2025
Record UNII
HUT8O9HA66
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-184745
Preferred Name English
.ALPHA.,.ALPHA.-BIS(2-(BIS(3-METHYL-2-BUTEN-1-YL)AMINO)ETHYL)-1-NAPHTHALENEACETONITRILE
Systematic Name English
1-NAPHTHALENEACETONITRILE, .ALPHA.,.ALPHA.-BIS(2-(BIS(3-METHYL-2-BUTENYL)AMINO)ETHYL)-
Systematic Name English
1-NAPHTHALENEACETONITRILE, ALPHA,ALPHA-BIS(2-(BIS(3-METHYL-2-BUTENYL)AMINO)ETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
HUT8O9HA66
Created by admin on Tue Apr 01 19:35:52 GMT 2025 , Edited by admin on Tue Apr 01 19:35:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID70198802
Created by admin on Tue Apr 01 19:35:52 GMT 2025 , Edited by admin on Tue Apr 01 19:35:52 GMT 2025
PRIMARY
NSC
184745
Created by admin on Tue Apr 01 19:35:52 GMT 2025 , Edited by admin on Tue Apr 01 19:35:52 GMT 2025
PRIMARY
PUBCHEM
39786
Created by admin on Tue Apr 01 19:35:52 GMT 2025 , Edited by admin on Tue Apr 01 19:35:52 GMT 2025
PRIMARY
CAS
50765-82-7
Created by admin on Tue Apr 01 19:35:52 GMT 2025 , Edited by admin on Tue Apr 01 19:35:52 GMT 2025
PRIMARY