6-ETHOXY-8-METHYLTROPINIUM BENZILATE BROMIDE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C25H32NO4.Br
Molecular Weight	490.43
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	0
Stereo Comments	Assumed epimeric

SHOW SMILES / InChI

Structure of 6-ETHOXY-8-METHYLTROPINIUM BENZILATE BROMIDE

Structure Search

SMILES

[Br-].CCOC1C[C@H]2C[C@H](C[C@@H]1[N+]2(C)C)OC(=O)C(O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=CLIMQORASMWLAB-GQXBGBBKSA-M

InChI=1S/C25H32NO4.BrH/c1-4-29-23-16-20-15-21(17-22(23)26(20,2)3)30-24(27)25(28,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14,20-23,28H,4,15-17H2,1-3H3;1H/q+1;/p-1/t20-,21-,22+,23?;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C25H31NO4
Molecular Weight	409.5179
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	BrH
Molecular Weight	80.912
Charge	0
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 `Fri Dec 15 15:03:16 GMT 2023` Edited by `admin` on `Fri Dec 15 15:03:16 GMT 2023`
Record UNII	GJ7VA61DMH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-ETHOXY-8-METHYLTROPINIUM BENZILATE BROMIDE

Common Name

English

6-ETHOXYTROPINE-BENZILIC ACID ESTER METHYLBROMIDE

Common Name

English

8-AZONIABICYCLO(3.2.1)OCTANE, 6-ETHOXY-3-((2-HYDROXY-2,2-DIPHENYLACETYL)OXY)-8,8-DIMETHYL-, BROMIDE (1:1)

Systematic Name

English

1.ALPHA.H,5.ALPHA.H-TROPANIUM, 6-ETHOXY-3.ALPHA.-HYDROXY-8-METHYL-, BROMIDE, BENZILATE

Systematic Name

English

6-ETHOXY-8-METHYLTROPINIUM BROMIDE, BENZILATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

137321703

Created by admin on Fri Dec 15 15:03:16 GMT 2023 , Edited by admin on Fri Dec 15 15:03:16 GMT 2023

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FDA UNII

GJ7VA61DMH

Created by admin on Fri Dec 15 15:03:16 GMT 2023 , Edited by admin on Fri Dec 15 15:03:16 GMT 2023

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CAS

22194-30-5

Created by admin on Fri Dec 15 15:03:16 GMT 2023 , Edited by admin on Fri Dec 15 15:03:16 GMT 2023

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