6-ETHOXY-8-METHYLTROPINIUM BENZILATE ION

Details

Stereochemistry	EPIMERIC
Molecular Formula	C25H32NO4
Molecular Weight	410.5259
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	1

SHOW SMILES / InChI

Structure of 6-ETHOXY-8-METHYLTROPINIUM BENZILATE ION

Structure Search

SMILES

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=CMMJNOFTJJWWAL-SSWODZADSA-N

InChI=1S/C25H32NO4/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/q+1/t20-,21-,22+,23?/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H31NO4
Molecular Weight	409.5179
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:16:50 GMT 2023` Edited by `admin` on `Sat Dec 16 14:16:50 GMT 2023`
Record UNII	HSL4BAA610
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-ETHOXY-8-METHYLTROPINIUM BENZILATE ION

Common Name

English

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

Systematic Name

English

Code System Code Type Description

CAS

743359-41-3

Created by admin on Sat Dec 16 14:16:50 GMT 2023 , Edited by admin on Sat Dec 16 14:16:50 GMT 2023

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FDA UNII

HSL4BAA610

Created by admin on Sat Dec 16 14:16:50 GMT 2023 , Edited by admin on Sat Dec 16 14:16:50 GMT 2023

PRIMARY

PUBCHEM

137321704

Created by admin on Sat Dec 16 14:16:50 GMT 2023 , Edited by admin on Sat Dec 16 14:16:50 GMT 2023

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