3-QUINUCLIDINYL-4-IODOBENZILATE, I-125 (-)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H22INO3
Molecular Weight	461.3089
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-QUINUCLIDINYL-4-IODOBENZILATE, I-125 (-)-

Structure Search

SMILES

O[C@@](C(=O)O[C@H]1CN2CCC1CC2)(C3=CC=CC=C3)C4=CC=C([125I])C=C4

InChI

InChIKey=MHBGDNWDRYOZPX-JRLZCWNESA-N

InChI=1S/C21H22INO3/c22-18-8-6-17(7-9-18)21(25,16-4-2-1-3-5-16)20(24)26-19-14-23-12-10-15(19)11-13-23/h1-9,15,19,25H,10-14H2/t19-,21-/m0/s1/i22-2

HIDE SMILES / InChI

Molecular Formula	C21H22INO3
Molecular Weight	461.3089
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 22:57:58 GMT 2025` Edited by `admin` on `Tue Apr 01 22:57:58 GMT 2025`
Record UNII	GMO97U8UJL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-QUINUCLIDINYL-4-IODOBENZILATE, (3R,S)-(I-125)-

Preferred Name

English

3-QUINUCLIDINYL-4-IODOBENZILATE, I-125 (-)-

Common Name

English

BENZENEACETIC ACID, .ALPHA.-HYDROXY-4-(IODO-125I)-.ALPHA.-PHENYL-, 1-AZABICYCLO(2.2.2)OCT-3-YL ESTER, (R-(R*,S*))-

Systematic Name

English

(-)-3R-QUINUCLIDINYL-(S)-(-).ALPHA.-HYDROXY-.ALPHA.-(4-IODOPHENYL)-.ALPHA.-PHENYL ACETATE, I-125

Systematic Name

English

(R)-(-)-3-QUINUCLIDINYL-(S)-.ALPHA.-HYDROXY-.ALPHA.-(4-(I-125)IODOPHENYL)-.ALPHA.-PHENYL ACETATE

Systematic Name

English

BENZENEACETIC ACID, .ALPHA.-HYDROXY-4-(IODO-125I)-.ALPHA.-PHENYL-, (3R)-1-AZABICYCLO(2.2.2)OCT-3-YL ESTER, (.ALPHA.S)-

Systematic Name

English

Code System Code Type Description

CAS

88000-63-9

Created by admin on Tue Apr 01 22:57:58 GMT 2025 , Edited by admin on Tue Apr 01 22:57:58 GMT 2025

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FDA UNII

GMO97U8UJL

Created by admin on Tue Apr 01 22:57:58 GMT 2025 , Edited by admin on Tue Apr 01 22:57:58 GMT 2025

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PUBCHEM

134687254

Created by admin on Tue Apr 01 22:57:58 GMT 2025 , Edited by admin on Tue Apr 01 22:57:58 GMT 2025

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3-QUINUCLIDINYL-4-IODOBENZILATE, (3R,S)-

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