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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H21NO4
Molecular Weight 279.3315
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AFUROLOL, (S)-

SMILES

CC(C)(C)NC[C@H](O)COC1=C2C(=O)OCC2=CC=C1

InChI

InChIKey=NFXPPCYKSAAUMQ-NSHDSACASA-N
InChI=1S/C15H21NO4/c1-15(2,3)16-7-11(17)9-19-12-6-4-5-10-8-20-14(18)13(10)12/h4-6,11,16-17H,7-9H2,1-3H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H21NO4
Molecular Weight 279.3315
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 Fri Dec 15 18:09:08 GMT 2023
Edited
by admin
on Fri Dec 15 18:09:08 GMT 2023
Record UNII
27L32GI11Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AFUROLOL, (S)-
Common Name English
1(3H)-ISOBENZOFURANONE, 7-(3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-, (S)-
Systematic Name English
Code System Code Type Description
FDA UNII
27L32GI11Z
Created by admin on Fri Dec 15 18:09:08 GMT 2023 , Edited by admin on Fri Dec 15 18:09:08 GMT 2023
PRIMARY
PUBCHEM
76964701
Created by admin on Fri Dec 15 18:09:08 GMT 2023 , Edited by admin on Fri Dec 15 18:09:08 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER