GLYCOPYRRONIUM TOSYLATE ANHYDROUS, THREO-

Details

Stereochemistry	RACEMIC
Molecular Formula	C19H28NO3.C7H7O3S
Molecular Weight	489.624
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of GLYCOPYRRONIUM TOSYLATE ANHYDROUS, THREO-

Structure Search

SMILES

CC1=CC=C(C=C1)S([O-])(=O)=O.C[N+]2(C)CC[C@H](C2)OC(=O)[C@@](O)(C3CCCC3)C4=CC=CC=C4

InChI

InChIKey=OFNFMAIFGLDTDC-ZFNKBKEPSA-M

InChI=1S/C19H28NO3.C7H8O3S/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15;1-6-2-4-7(5-3-6)11(8,9)10/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/t17-,19+;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C19H28NO3
Molecular Weight	318.4305
Charge	1
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C7H7O3S
Molecular Weight	171.194
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 `Sat Dec 16 11:30:22 GMT 2023` Edited by `admin` on `Sat Dec 16 11:30:22 GMT 2023`
Record UNII	11T1267W3A
Record Status	`Validated (UNII)`
Record Version