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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H17Cl2NO2
Molecular Weight 326.218
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL (1R,5S)-3-(3,4-DICHLOROPHENYL)-8-METHYL-8-AZABICYCLO(3.2.1)OCT-2-ENE-2-CARBOXYLATE

SMILES

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C)C3=CC=C(Cl)C(Cl)=C3

InChI

InChIKey=OVLMCLBVTLFJPW-IINYFYTJSA-N
InChI=1S/C16H17Cl2NO2/c1-19-10-4-6-14(19)15(16(20)21-2)11(8-10)9-3-5-12(17)13(18)7-9/h3,5,7,10,14H,4,6,8H2,1-2H3/t10-,14+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H17Cl2NO2
Molecular Weight 326.218
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:13:04 GMT 2025
Edited
by admin
on Mon Mar 31 22:13:04 GMT 2025
Record UNII
X3VA2E83ZV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL (1R,5S)-3-(3,4-DICHLOROPHENYL)-8-METHYL-8-AZABICYCLO(3.2.1)OCT-2-ENE-2-CARBOXYLATE
Systematic Name English
O-1109
Preferred Name English
8-AZABICYCLO(3.2.1)OCT-2-ENE-2-CARBOXYLIC ACID, 3-(3,4-DICHLOROPHENYL)-8-METHYL-, METHYL ESTER, (1R,5S)-
Systematic Name English
O1109
Code English
Code System Code Type Description
FDA UNII
X3VA2E83ZV
Created by admin on Mon Mar 31 22:13:04 GMT 2025 , Edited by admin on Mon Mar 31 22:13:04 GMT 2025
PRIMARY
PUBCHEM
11141959
Created by admin on Mon Mar 31 22:13:04 GMT 2025 , Edited by admin on Mon Mar 31 22:13:04 GMT 2025
PRIMARY
CAS
211046-98-9
Created by admin on Mon Mar 31 22:13:04 GMT 2025 , Edited by admin on Mon Mar 31 22:13:04 GMT 2025
PRIMARY