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Details

Stereochemistry ACHIRAL
Molecular Formula C17H19N3O
Molecular Weight 281.3523
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-ETHYL-3,7-DIHYDRO-6,7-DIMETHYL-5-PHENYLPYRROLO(3,4-E)-1,4-DIAZEPIN-2(1H)-ONE

SMILES

CCC1=C2NC(=O)CN=C(C2=C(C)N1C)C3=CC=CC=C3

InChI

InChIKey=QUIPVRAMGQYMNN-UHFFFAOYSA-N
InChI=1S/C17H19N3O/c1-4-13-17-15(11(2)20(13)3)16(18-10-14(21)19-17)12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3,(H,19,21)

HIDE SMILES / InChI

Molecular Formula C17H19N3O
Molecular Weight 281.3523
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 Sat Dec 16 12:55:25 GMT 2023
Edited
by admin
on Sat Dec 16 12:55:25 GMT 2023
Record UNII
9J9YLB6XNL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-ETHYL-3,7-DIHYDRO-6,7-DIMETHYL-5-PHENYLPYRROLO(3,4-E)-1,4-DIAZEPIN-2(1H)-ONE
Systematic Name English
NSC-290941
Code English
PYRROLO(3,4-E)(1,4)DIAZEPIN-2(1H)-ONE, 3,7-DIHYDRO-6,7-DIMETHYL-8-ETHYL-5-PHENYL-
Systematic Name English
PYRROLO(3,4-E)-1,4-DIAZEPIN-2(1H)-ONE, 8-ETHYL-3,7-DIHYDRO-6,7-DIMETHYL-5-PHENYL-
Systematic Name English
Code System Code Type Description
NSC
290941
Created by admin on Sat Dec 16 12:55:25 GMT 2023 , Edited by admin on Sat Dec 16 12:55:25 GMT 2023
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PUBCHEM
100342
Created by admin on Sat Dec 16 12:55:25 GMT 2023 , Edited by admin on Sat Dec 16 12:55:25 GMT 2023
PRIMARY
FDA UNII
9J9YLB6XNL
Created by admin on Sat Dec 16 12:55:25 GMT 2023 , Edited by admin on Sat Dec 16 12:55:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID80206028
Created by admin on Sat Dec 16 12:55:25 GMT 2023 , Edited by admin on Sat Dec 16 12:55:25 GMT 2023
PRIMARY
CAS
57435-88-8
Created by admin on Sat Dec 16 12:55:25 GMT 2023 , Edited by admin on Sat Dec 16 12:55:25 GMT 2023
PRIMARY