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Details

Stereochemistry RACEMIC
Molecular Formula C21H15NO2
Molecular Weight 313.3493
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DIHYDRODIBENZ(A,J)ACRIDINE-3,4-DIOL, TRANS-(±)-

SMILES

O[C@H]1C=CC2=C3C=C4C(C=CC5=CC=CC=C45)=NC3=CC=C2[C@@H]1O

InChI

InChIKey=LWQQPBNWXMYMEF-SFTDATJTSA-N
InChI=1S/C21H15NO2/c23-20-10-7-14-15(21(20)24)6-9-19-17(14)11-16-13-4-2-1-3-12(13)5-8-18(16)22-19/h1-11,20-21,23-24H/t20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H15NO2
Molecular Weight 313.3493
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 09:12:28 GMT 2023
Edited
by admin
on Sat Dec 16 09:12:28 GMT 2023
Record UNII
Z4B6F08KXO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-DIHYDRODIBENZ(A,J)ACRIDINE-3,4-DIOL, TRANS-(±)-
Systematic Name English
TRANS-3,4-DIHYDROXY-3,4-DIHYDRODIBENZ(A,J)ACRIDINE
Systematic Name English
TRANS-3,4-DIHYDRODIBENZ(A,J)ACRIDINE-3,4-DIOL, (±)-
Systematic Name English
DIBENZ(A,J)ACRIDINE-3,4-DIOL, 3,4-DIHYDRO-, (3R,4R)-REL-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID10909550
Created by admin on Sat Dec 16 09:12:28 GMT 2023 , Edited by admin on Sat Dec 16 09:12:28 GMT 2023
PRIMARY
CAS
105467-65-0
Created by admin on Sat Dec 16 09:12:28 GMT 2023 , Edited by admin on Sat Dec 16 09:12:28 GMT 2023
PRIMARY
FDA UNII
Z4B6F08KXO
Created by admin on Sat Dec 16 09:12:28 GMT 2023 , Edited by admin on Sat Dec 16 09:12:28 GMT 2023
PRIMARY
PUBCHEM
146658
Created by admin on Sat Dec 16 09:12:28 GMT 2023 , Edited by admin on Sat Dec 16 09:12:28 GMT 2023
PRIMARY
CAS
117066-30-5
Created by admin on Sat Dec 16 09:12:28 GMT 2023 , Edited by admin on Sat Dec 16 09:12:28 GMT 2023
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