ILMETROPIUM IODIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C20H30NO3.I
Molecular Weight	459.3616
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[I-].CCC(CO)(C(=O)O[C@@H]1C[C@@H]2CC[C@H](C1)[N+]2(C)C)C3=CC=CC=C3

InChI

InChIKey=PIQNXFBDPDECGD-WIYVAMDUSA-M

InChI=1S/C20H30NO3.HI/c1-4-20(14-22,15-8-6-5-7-9-15)19(23)24-18-12-16-10-11-17(13-18)21(16,2)3;/h5-9,16-18,22H,4,10-14H2,1-3H3;1H/q+1;/p-1/t16-,17+,18+,20?;

HIDE SMILES / InChI

Molecular Formula	HI
Molecular Weight	127.91241
Charge	0
Count

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

Molecular Formula	C20H29NO3
Molecular Weight	331.4492
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	3 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:41:22 GMT 2025` Edited by `admin` on `Tue Apr 01 16:41:22 GMT 2025`
Record UNII	DK37Q6P754
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ILMETROPIUM IODIDE

Official Name

English

ilmetropium iodide [INN]

Preferred Name

English

(3-ENDO)-3-(2-(HYDROXYMETHYL)-1-OXO-2-PHENYLBUTOXY)-8,8-DIMETHYL-8-AZONIABICYCLO(3.2.1)OCTANE IODIDE (1:1)

Systematic Name

English

8-AZONIABICYCLO(3.2.1)OCTANE, 3-(2-(HYDROXYMETHYL)-1-OXO-2-PHENYLBUTOXY)-8,8-DIMETHYL-, IODIDE (1:1), (3-ENDO)

Systematic Name

English

Troventol [WHO-DD]

Common Name

English

(1R,3R,5S)-3-(((2RS)-2-(HYDROXYMETHYL)- 2-PHENYLBUTANOYL)OXY)-8,8-DIMETHYL- 8-AZABICYCLO(3.2.1)OCTANIUM IODIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

DK37Q6P754