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Details

Stereochemistry ACHIRAL
Molecular Formula C25H20N2O3
Molecular Weight 396.4379
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PBOX-6

SMILES

CN(C)C(=O)OC1=C(OC2=CC=CC=C2N3C=CC=C13)C4=C5C=CC=CC5=CC=C4

InChI

InChIKey=SOIZAFVNIXAZFQ-UHFFFAOYSA-N
InChI=1S/C25H20N2O3/c1-26(2)25(28)30-24-21-14-8-16-27(21)20-13-5-6-15-22(20)29-23(24)19-12-7-10-17-9-3-4-11-18(17)19/h3-16H,1-2H3

HIDE SMILES / InChI

Molecular Formula C25H20N2O3
Molecular Weight 396.4379
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:53:16 GMT 2023
Edited
by admin
on Sat Dec 16 09:53:16 GMT 2023
Record UNII
IN93MQ497D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PBOX-6
Common Name English
CARBAMIC ACID, N,N-DIMETHYL-, 6-(1-NAPHTHALENYL)PYRROLO(2,1-D)(1,5)BENZOXAZEPIN-7-YL ESTER
Systematic Name English
CARBAMIC ACID, DIMETHYL-, 6-(1-NAPHTHALENYL)PYRROLO(2,1-D)(1,5)BENZOXAZEPIN-7-YL ESTER
Systematic Name English
Code System Code Type Description
CAS
290814-68-5
Created by admin on Sat Dec 16 09:53:16 GMT 2023 , Edited by admin on Sat Dec 16 09:53:16 GMT 2023
PRIMARY
FDA UNII
IN93MQ497D
Created by admin on Sat Dec 16 09:53:16 GMT 2023 , Edited by admin on Sat Dec 16 09:53:16 GMT 2023
PRIMARY
PUBCHEM
9865511
Created by admin on Sat Dec 16 09:53:16 GMT 2023 , Edited by admin on Sat Dec 16 09:53:16 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY