Ipratropium bromide, anti-

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H30NO3.Br
Molecular Weight	412.361
Optical Activity	( + / - )
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Br-].CC(C)[N@@+]1(C)[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)C3=CC=CC=C3

InChI

InChIKey=LHLMOSXCXGLMMN-QSCOGLFNSA-M

InChI=1S/C20H30NO3.BrH/c1-14(2)21(3)16-9-10-17(21)12-18(11-16)24-20(23)19(13-22)15-7-5-4-6-8-15;/h4-8,14,16-19,22H,9-13H2,1-3H3;1H/q+1;/p-1/t16-,17+,18+,19?,21-;

HIDE SMILES / InChI

Molecular Formula	Br
Molecular Weight	79.904
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C20H30NO3
Molecular Weight	332.4571
Charge	1
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	4 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 19:04:04 GMT 2025` Edited by `admin` on `Wed Apr 02 19:04:04 GMT 2025`
Record UNII	LQC8KL4SYU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SCH-1178

Preferred Name

English

Ipratropium bromide, anti-

Common Name

English

8-Azoniabicyclo[3.2.1]octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8-methyl-8-(1-methylethyl)-, bromide (1:1), (3-endo,8-anti)-

Systematic Name

English

8-Azoniabicyclo[3.2.1]octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8-methyl-8-(1-methylethyl)-, bromide, (3-endo,8-anti)-

Systematic Name

English

Code System Code Type Description

FDA UNII

LQC8KL4SYU

Created by admin on Wed Apr 02 19:04:04 GMT 2025 , Edited by admin on Wed Apr 02 19:04:04 GMT 2025

PRIMARY

CAS

58073-59-9

Created by admin on Wed Apr 02 19:04:04 GMT 2025 , Edited by admin on Wed Apr 02 19:04:04 GMT 2025

PRIMARY

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