8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXALDEHYDE, 3-(3,4-DICHLOROPHENYL)-, O-METHYLOXIME, (C(E),1R,2R,3S,5S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C15H18Cl2N2O
Molecular Weight	313.222
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXALDEHYDE, 3-(3,4-DICHLOROPHENYL)-, O-METHYLOXIME, (C(E),1R,2R,3S,5S)-

Structure Search

SMILES

CO\N=C\[C@H]1[C@H]2CC[C@@H](C[C@@H]1C3=CC(Cl)=C(Cl)C=C3)N2

InChI

InChIKey=DOQGCMWUTVSEPX-WMGZZIQCSA-N

InChI=1S/C15H18Cl2N2O/c1-20-18-8-12-11(7-10-3-5-15(12)19-10)9-2-4-13(16)14(17)6-9/h2,4,6,8,10-12,15,19H,3,5,7H2,1H3/b18-8+/t10-,11+,12+,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C15H18Cl2N2O
Molecular Weight	313.222
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 08:01:23 GMT 2025` Edited by `admin` on `Wed Apr 02 08:01:23 GMT 2025`
Record UNII	J3QY6NWV82
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXALDEHYDE, 3-(3,4-DICHLOROPHENYL)-, O-METHYLOXIME, (C(E),1R,2R,3S,5S)-

Systematic Name

English

BMS-212702

Preferred Name

English

N-DESMETHYL BRASOFENSINE

Common Name

English

NS 2262

Common Name

English

NDME

Common Name

English

Code System Code Type Description

CAS

200558-52-7

Created by admin on Wed Apr 02 08:01:23 GMT 2025 , Edited by admin on Wed Apr 02 08:01:23 GMT 2025

PRIMARY

PUBCHEM

15322312

Created by admin on Wed Apr 02 08:01:23 GMT 2025 , Edited by admin on Wed Apr 02 08:01:23 GMT 2025

PRIMARY

FDA UNII

J3QY6NWV82

Created by admin on Wed Apr 02 08:01:23 GMT 2025 , Edited by admin on Wed Apr 02 08:01:23 GMT 2025

PRIMARY

Related Record Type Details


					1YP2S94RVH

BRASOFENSINE

PARENT -> METABOLITE

Qualification:

PLASMA

Amount: