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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H23N3O6
Molecular Weight 389.4024
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XANTHOANTHRAFIL, (R)-

SMILES

COC1=CC=C(CNC(=O)C2=CC(=CC=C2N[C@H](C)CO)[N+]([O-])=O)C=C1OC

InChI

InChIKey=ZISFCTXLAXIEMV-GFCCVEGCSA-N
InChI=1S/C19H23N3O6/c1-12(11-23)21-16-6-5-14(22(25)26)9-15(16)19(24)20-10-13-4-7-17(27-2)18(8-13)28-3/h4-9,12,21,23H,10-11H2,1-3H3,(H,20,24)/t12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H23N3O6
Molecular Weight 389.4024
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 06:36:02 GMT 2023
Edited
by admin
on Sat Dec 16 06:36:02 GMT 2023
Record UNII
IAU22ZHP0V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTHOANTHRAFIL, (R)-
Common Name English
(R)-BENZAMIDENAFIL
Common Name English
FR-226807
Code English
BENZAMIDE, N-((3,4-DIMETHOXYPHENYL)METHYL)-2-(((1R)-2-HYDROXY-1-METHYLETHYL)AMINO)-5-NITRO-
Systematic Name English
(R)-XANTHOANTHRAFIL
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID50179477
Created by admin on Sat Dec 16 06:36:02 GMT 2023 , Edited by admin on Sat Dec 16 06:36:02 GMT 2023
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FDA UNII
IAU22ZHP0V
Created by admin on Sat Dec 16 06:36:02 GMT 2023 , Edited by admin on Sat Dec 16 06:36:02 GMT 2023
PRIMARY
CAS
247568-68-9
Created by admin on Sat Dec 16 06:36:02 GMT 2023 , Edited by admin on Sat Dec 16 06:36:02 GMT 2023
PRIMARY
PUBCHEM
9821702
Created by admin on Sat Dec 16 06:36:02 GMT 2023 , Edited by admin on Sat Dec 16 06:36:02 GMT 2023
PRIMARY