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Details

Stereochemistry RACEMIC
Molecular Formula C11H15N3
Molecular Weight 189.2569
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,3,4,5-TETRAHYDRO-1H-1,5-METHANOBENZO(D)AZEPINE-6,8-DIAMINE

SMILES

NC1=CC(N)=C2[C@@H]3C[C@@H](CNC3)C2=C1

InChI

InChIKey=GCAUCUQYUATCPG-NKWVEPMBSA-N
InChI=1S/C11H15N3/c12-8-2-9-6-1-7(5-14-4-6)11(9)10(13)3-8/h2-3,6-7,14H,1,4-5,12-13H2/t6-,7+/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H15N3
Molecular Weight 189.2569
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 18:31:00 GMT 2023
Edited
by admin
on Sat Dec 16 18:31:00 GMT 2023
Record UNII
U5W4YJR6U7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3,4,5-TETRAHYDRO-1H-1,5-METHANOBENZO(D)AZEPINE-6,8-DIAMINE
Systematic Name English
Varenicline Impurity 8
Common Name English
Code System Code Type Description
PUBCHEM
155928933
Created by admin on Sat Dec 16 18:31:00 GMT 2023 , Edited by admin on Sat Dec 16 18:31:00 GMT 2023
PRIMARY
FDA UNII
U5W4YJR6U7
Created by admin on Sat Dec 16 18:31:00 GMT 2023 , Edited by admin on Sat Dec 16 18:31:00 GMT 2023
PRIMARY
CAS
950781-91-6
Created by admin on Sat Dec 16 18:31:00 GMT 2023 , Edited by admin on Sat Dec 16 18:31:00 GMT 2023
PRIMARY