OPRATONIUM IODIDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H35N2O.I
Molecular Weight	410.3771
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OPRATONIUM IODIDE

Structure Search

SMILES

[I-].C[N+](C)(C)CCCNC(=O)CCCCCCCCC=C

InChI

InChIKey=NXLJXARAIIJYAJ-UHFFFAOYSA-N

InChI=1S/C17H34N2O.HI/c1-5-6-7-8-9-10-11-12-14-17(20)18-15-13-16-19(2,3)4;/h5H,1,6-16H2,2-4H3;1H

HIDE SMILES / InChI

Molecular Formula	HI
Molecular Weight	127.9124
Charge	0
Count

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

Molecular Formula	C17H35N2O
Molecular Weight	283.4726
Charge	1
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:58:55 GMT 2023` Edited by `admin` on `Fri Dec 15 15:58:55 GMT 2023`
Record UNII	DHP4EXW0RL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OPRATONIUM IODIDE

Official Name

English

opratonium iodide [INN]

Common Name

English

TRIMETHYL(3-(10-UNDECENAMIDO)PROPYL)AMMONIUM IODIDE

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C28394

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

Code System Code Type Description

INN

7552

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

NCI_THESAURUS

C90988

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

EVMPD

SUB09451MIG

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

FDA UNII

DHP4EXW0RL

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

PUBCHEM

3047804

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

CAS

210419-36-6

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

ChEMBL

CHEMBL2110658

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

EPA CompTox

DTXSID30943350

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

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SMS_ID

100000083342

Created by admin on Fri Dec 15 15:58:55 GMT 2023 , Edited by admin on Fri Dec 15 15:58:55 GMT 2023

PRIMARY

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