1-CYCLOPENTYL-2-((1-METHYLPIPERIDIN-4-YL)OXY)-2-OXO-1-PHENYLETHYL BENZOATE HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C26H31NO4.ClH
Molecular Weight	457.99
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0
Stereo Comments	Assumed racemic

SHOW SMILES / InChI

Structure of 1-CYCLOPENTYL-2-((1-METHYLPIPERIDIN-4-YL)OXY)-2-OXO-1-PHENYLETHYL BENZOATE HYDROCHLORIDE

Structure Search

SMILES

Cl.CN1CCC(CC1)OC(=O)C(OC(=O)C2=CC=CC=C2)(C3CCCC3)C4=CC=CC=C4

InChI

InChIKey=FTFQJDIUKLBMMG-UHFFFAOYSA-N

InChI=1S/C26H31NO4.ClH/c1-27-18-16-23(17-19-27)30-25(29)26(22-14-8-9-15-22,21-12-6-3-7-13-21)31-24(28)20-10-4-2-5-11-20;/h2-7,10-13,22-23H,8-9,14-19H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula	C26H31NO4
Molecular Weight	421.5286
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	ClH
Molecular Weight	36.461
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 `Mon Mar 31 17:53:36 GMT 2025` Edited by `admin` on `Mon Mar 31 17:53:36 GMT 2025`
Record UNII	77L1SN3B1U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BENZENEACETIC ACID, .ALPHA.-(BENZOYLOXY)-.ALPHA.-CYCLOPENTYL-, 1-METHYL-4-PIPERIDINYL ESTER, HYDROCHLORIDE (1:1)

Preferred Name

English

1-CYCLOPENTYL-2-((1-METHYLPIPERIDIN-4-YL)OXY)-2-OXO-1-PHENYLETHYL BENZOATE HYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

3047394

Created by admin on Mon Mar 31 17:53:36 GMT 2025 , Edited by admin on Mon Mar 31 17:53:36 GMT 2025

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CAS

63490-88-0

Created by admin on Mon Mar 31 17:53:36 GMT 2025 , Edited by admin on Mon Mar 31 17:53:36 GMT 2025

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FDA UNII

77L1SN3B1U

Created by admin on Mon Mar 31 17:53:36 GMT 2025 , Edited by admin on Mon Mar 31 17:53:36 GMT 2025

PRIMARY

EPA CompTox

DTXSID50979712

Created by admin on Mon Mar 31 17:53:36 GMT 2025 , Edited by admin on Mon Mar 31 17:53:36 GMT 2025

PRIMARY

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1-CYCLOPENTYL-2-((1-METHYLPIPERIDIN-4-YL)OXY)-2-OXO-1-PHENYLETHYL BENZOATE

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