U-77891

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H24Br2N2O
Molecular Weight	444.204
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of U-77891

Structure Search

SMILES

CN([C@@H]1CCCC[C@]12CCCN2C)C(=O)C3=CC(Br)=C(Br)C=C3

InChI

InChIKey=XHBTZWGPHRHWQZ-AEFFLSMTSA-N

InChI=1S/C18H24Br2N2O/c1-21-11-5-10-18(21)9-4-3-6-16(18)22(2)17(23)13-7-8-14(19)15(20)12-13/h7-8,12,16H,3-6,9-11H2,1-2H3/t16-,18+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H24Br2N2O
Molecular Weight	444.204
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 `Wed Apr 02 08:24:04 GMT 2025` Edited by `admin` on `Wed Apr 02 08:24:04 GMT 2025`
Record UNII	7P6974D7RX
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

U-77891

Code

English

BENZAMIDE, 3,4-DIBROMO-N-METHYL-N-((5R,6S)-1-METHYL-1-AZASPIRO(4.5)DEC-6-YL)-, REL-

Preferred Name

English

BENZAMIDE, 3,4-DIBROMO-N-METHYL-N-(1-METHYL-1-AZASPIRO(4.5)DEC-6-YL)-, TRANS-(±)-

Systematic Name

English

Code System Code Type Description

CAS

119878-31-8

Created by admin on Wed Apr 02 08:24:04 GMT 2025 , Edited by admin on Wed Apr 02 08:24:04 GMT 2025

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EPA CompTox

DTXSID901031667

Created by admin on Wed Apr 02 08:24:04 GMT 2025 , Edited by admin on Wed Apr 02 08:24:04 GMT 2025

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WIKIPEDIA

U-77891

Created by admin on Wed Apr 02 08:24:04 GMT 2025 , Edited by admin on Wed Apr 02 08:24:04 GMT 2025

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PUBCHEM

117071705

Created by admin on Wed Apr 02 08:24:04 GMT 2025 , Edited by admin on Wed Apr 02 08:24:04 GMT 2025

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FDA UNII

7P6974D7RX

Created by admin on Wed Apr 02 08:24:04 GMT 2025 , Edited by admin on Wed Apr 02 08:24:04 GMT 2025

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