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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H7NO3
Molecular Weight 177.1568
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(3-ISOCYANO-6-OXABICYCLO(3.1.0)HEX-2-EN-5-YL)ACRYLIC ACID, (1S,5S)-

SMILES

OC(=O)\C=C\[C@@]12CC(=C[C@@H]1O2)[N+]#[C-]

InChI

InChIKey=HNYIOENSKUGAAX-CZQIOHHCSA-N
InChI=1S/C9H7NO3/c1-10-6-4-7-9(5-6,13-7)3-2-8(11)12/h2-4,7H,5H2,(H,11,12)/b3-2+/t7-,9+/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H7NO3
Molecular Weight 177.1568
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:30:08 GMT 2023
Edited
by admin
on Sat Dec 16 11:30:08 GMT 2023
Record UNII
5SB0SE127O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(3-ISOCYANO-6-OXABICYCLO(3.1.0)HEX-2-EN-5-YL)ACRYLIC ACID, (1S,5S)-
Common Name English
3-(3-ISOCYANO-6-OXABICYCLO(3.1.0)HEX-2-EN-5-YL)ACRYLIC ACID
Systematic Name English
2-PROPENOIC ACID, 3-(3-ISOCYANO-6-OXABICYCLO(3.1.0)HEX-3-EN-1-YL)-, (E)-
Systematic Name English
Code System Code Type Description
CAS
73372-97-1
Created by admin on Sat Dec 16 11:30:08 GMT 2023 , Edited by admin on Sat Dec 16 11:30:08 GMT 2023
PRIMARY
FDA UNII
5SB0SE127O
Created by admin on Sat Dec 16 11:30:08 GMT 2023 , Edited by admin on Sat Dec 16 11:30:08 GMT 2023
PRIMARY
PUBCHEM
119025823
Created by admin on Sat Dec 16 11:30:08 GMT 2023 , Edited by admin on Sat Dec 16 11:30:08 GMT 2023
PRIMARY