apo-Ipratropium Bromide

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H28NO2.Br
Molecular Weight	394.346
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
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(=C)C3=CC=CC=C3

InChI

InChIKey=KUACVKTWUWIQFV-WKMKWORLSA-M

InChI=1S/C20H28NO2.BrH/c1-14(2)21(4)17-10-11-18(21)13-19(12-17)23-20(22)15(3)16-8-6-5-7-9-16;/h5-9,14,17-19H,3,10-13H2,1-2,4H3;1H/q+1;/p-1/t17-,18+,19+,21+;

HIDE SMILES / InChI

Molecular Formula	C20H28NO2
Molecular Weight	314.4418
Charge	1
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:51:12 GMT 2025` Edited by `admin` on `Mon Mar 31 22:51:12 GMT 2025`
Record UNII	7FLF3X5JU4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

apo-Ipratropium Bromide

Common Name

English

BA 686

Preferred Name

English

.ALPHA.-PHENYLACRYLIC ACID-N-ISO-PROPYLNORTROPINE-ESTER METHOBROMIDE

Common Name

English

8-Azoniabicyclo[3.2.1]octane, 8-methyl-8-(1-methylethyl)-3-[(1-oxo-2-phenyl-2-propen-1-yl)oxy]-, bromide (1:1), (3-endo,8-syn)-

Systematic Name

English

BA-686

Code

English

Code System Code Type Description

FDA UNII

7FLF3X5JU4

Created by admin on Mon Mar 31 22:51:12 GMT 2025 , Edited by admin on Mon Mar 31 22:51:12 GMT 2025

PRIMARY

PUBCHEM

16742141

Created by admin on Mon Mar 31 22:51:12 GMT 2025 , Edited by admin on Mon Mar 31 22:51:12 GMT 2025

PRIMARY

CAS

60018-35-1

Created by admin on Mon Mar 31 22:51:12 GMT 2025 , Edited by admin on Mon Mar 31 22:51:12 GMT 2025

PRIMARY

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