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Details

Stereochemistry ACHIRAL
Molecular Formula C16H15N5O3
Molecular Weight 325.322
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-amino-3,4,4-trimethyl-1-(4-nitrophenyl)-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile

SMILES

CC1=NN(C2=C1C(C)(C)C(C#N)=C(N)O2)C3=CC=C(C=C3)[N+]([O-])=O

InChI

InChIKey=RMEPMOIEPBKECI-UHFFFAOYSA-N
InChI=1S/C16H15N5O3/c1-9-13-15(24-14(18)12(8-17)16(13,2)3)20(19-9)10-4-6-11(7-5-10)21(22)23/h4-7H,18H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C16H15N5O3
Molecular Weight 325.322
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 12:57:03 GMT 2023
Edited
by admin
on Sat Dec 16 12:57:03 GMT 2023
Record UNII
A47TCG63GV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-amino-3,4,4-trimethyl-1-(4-nitrophenyl)-1H,4H-pyrano[2,3-c]pyrazole-5-carbonitrile
Systematic Name English
Pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-1,4-dihydro-3,4,4-trimethyl-1-(4-nitrophenyl)-
Systematic Name English
NSC-353639
Code English
6-AMINO-1-(4-(HYDROXY(OXIDO)AMINO)PHENYL)-3,4,4-TRIMETHYL-1,4-DIHYDROPYRANO(2,3-C)PYRAZOLE-5-CARBONITRILE
Systematic Name English
Code System Code Type Description
FDA UNII
A47TCG63GV
Created by admin on Sat Dec 16 12:57:03 GMT 2023 , Edited by admin on Sat Dec 16 12:57:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID60227756
Created by admin on Sat Dec 16 12:57:03 GMT 2023 , Edited by admin on Sat Dec 16 12:57:03 GMT 2023
PRIMARY
CAS
76973-33-6
Created by admin on Sat Dec 16 12:57:03 GMT 2023 , Edited by admin on Sat Dec 16 12:57:03 GMT 2023
PRIMARY
PUBCHEM
337026
Created by admin on Sat Dec 16 12:57:03 GMT 2023 , Edited by admin on Sat Dec 16 12:57:03 GMT 2023
PRIMARY
NSC
353639
Created by admin on Sat Dec 16 12:57:03 GMT 2023 , Edited by admin on Sat Dec 16 12:57:03 GMT 2023
PRIMARY