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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H23NO2.ClH
Molecular Weight 345.863
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CI-201-678

SMILES

Cl.[H][C@@]12CC3=C(C(O)=C(O)C=C3)C4=C1C(=CC=C4)[C@H](CCC)N2CC

InChI

InChIKey=GEWBTAUZIRYZCI-IDVLALEDSA-N
InChI=1S/C20H23NO2.ClH/c1-3-6-15-13-7-5-8-14-18-12(9-10-17(22)20(18)23)11-16(19(13)14)21(15)4-2;/h5,7-10,15-16,22-23H,3-4,6,11H2,1-2H3;1H/t15-,16+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C20H23NO2
Molecular Weight 309.4021
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
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 Fri Dec 15 15:54:12 GMT 2023
Edited
by admin
on Fri Dec 15 15:54:12 GMT 2023
Record UNII
VJK4O2H63I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CI-201-678
Code English
CI-201678
Code English
DIBENZ(CD,F)INDOLE-9,10-DIOL, 5-ETHYL-4,5,5A,6-TETRAHYDRO-4-PROPYL-, HYDROCHLORIDE, (4S,5AR)-
Systematic Name English
DIBENZ(CD,F)INDOLE-9,10-DIOL, 5-ETHYL-4,5,5A,6-TETRAHYDRO-4-PROPYL-, HYDROCHLORIDE, (4S-TRANS)-
Common Name English
Code System Code Type Description
PUBCHEM
13729226
Created by admin on Fri Dec 15 15:54:12 GMT 2023 , Edited by admin on Fri Dec 15 15:54:12 GMT 2023
PRIMARY
CAS
82188-33-8
Created by admin on Fri Dec 15 15:54:12 GMT 2023 , Edited by admin on Fri Dec 15 15:54:12 GMT 2023
PRIMARY
FDA UNII
VJK4O2H63I
Created by admin on Fri Dec 15 15:54:12 GMT 2023 , Edited by admin on Fri Dec 15 15:54:12 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE