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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H25N3
Molecular Weight 295.4219
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of U-92016A

SMILES

CCCN(CCC)[C@@H]1CCC2=C(C1)C3=C(NC(=C3)C#N)C=C2

InChI

InChIKey=WDDZPZKGLZNGEH-MRXNPFEDSA-N
InChI=1S/C19H25N3/c1-3-9-22(10-4-2)16-7-5-14-6-8-19-18(17(14)12-16)11-15(13-20)21-19/h6,8,11,16,21H,3-5,7,9-10,12H2,1-2H3/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H25N3
Molecular Weight 295.4219
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:20:19 UTC 2023
Edited
by admin
on Sat Dec 16 19:20:19 UTC 2023
Record UNII
9JQ994EAB3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
U-92016A
Code English
U-92016A free base
Code English
(8R)-8-(Dipropylamino)-6,7,8,9-tetrahydro-3H-benz[e]indole-2-carbonitrile
Systematic Name English
3H-Benz[e]indole-2-carbonitrile, 8-(dipropylamino)-6,7,8,9-tetrahydro-, (R)-
Systematic Name English
3H-Benz[e]indole-2-carbonitrile, 8-(dipropylamino)-6,7,8,9-tetrahydro-, (8R)-
Systematic Name English
Code System Code Type Description
FDA UNII
9JQ994EAB3
Created by admin on Sat Dec 16 19:20:19 UTC 2023 , Edited by admin on Sat Dec 16 19:20:19 UTC 2023
PRIMARY
EPA CompTox
DTXSID80929583
Created by admin on Sat Dec 16 19:20:19 UTC 2023 , Edited by admin on Sat Dec 16 19:20:19 UTC 2023
PRIMARY
CAS
136924-88-4
Created by admin on Sat Dec 16 19:20:19 UTC 2023 , Edited by admin on Sat Dec 16 19:20:19 UTC 2023
PRIMARY
PUBCHEM
9904242
Created by admin on Sat Dec 16 19:20:19 UTC 2023 , Edited by admin on Sat Dec 16 19:20:19 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> AGONIST