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Details

Stereochemistry RACEMIC
Molecular Formula C8H13N
Molecular Weight 123.1955
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3A,4,7,7A-TETRAHYDROISOINDOLINE, TRANS-

SMILES

[H][C@@]12CNC[C@@]1([H])CC=CC2

InChI

InChIKey=HWZHYUCYEYJQTE-HTQZYQBOSA-N
InChI=1S/C8H13N/c1-2-4-8-6-9-5-7(8)3-1/h1-2,7-9H,3-6H2/t7-,8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C8H13N
Molecular Weight 123.1955
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:50:58 GMT 2023
Edited
by admin
on Sat Dec 16 14:50:58 GMT 2023
Record UNII
8LR8AG9Z4U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3A,4,7,7A-TETRAHYDROISOINDOLINE, TRANS-
Systematic Name English
1H-ISOINDOLE, 2,3,3A,4,7,7A-HEXAHYDRO-, TRANS-(±)-
Systematic Name English
1H-ISOINDOLE, 2,3,3A,4,7,7A-HEXAHYDRO-, (3AR,7AR)-REL-
Systematic Name English
Code System Code Type Description
PUBCHEM
28665047
Created by admin on Sat Dec 16 14:50:58 GMT 2023 , Edited by admin on Sat Dec 16 14:50:58 GMT 2023
PRIMARY
CAS
52865-33-5
Created by admin on Sat Dec 16 14:50:58 GMT 2023 , Edited by admin on Sat Dec 16 14:50:58 GMT 2023
PRIMARY
FDA UNII
8LR8AG9Z4U
Created by admin on Sat Dec 16 14:50:58 GMT 2023 , Edited by admin on Sat Dec 16 14:50:58 GMT 2023
PRIMARY