ER-127528

Details

Stereochemistry	RACEMIC
Molecular Formula	C24H27F2NO3.ClH
Molecular Weight	451.934
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.COC1=CC2=C(C=C1OC)C(=O)C(F)(CC3CCN(CC4=CC=CC(F)=C4)CC3)C2

InChI

InChIKey=FWMCRDREDHSOJK-UHFFFAOYSA-N

InChI=1S/C24H27F2NO3.ClH/c1-29-21-11-18-14-24(26,23(28)20(18)12-22(21)30-2)13-16-6-8-27(9-7-16)15-17-4-3-5-19(25)10-17;/h3-5,10-12,16H,6-9,13-15H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula	C24H27F2NO3
Molecular Weight	415.4729
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 `Sat Dec 16 08:25:46 GMT 2023` Edited by `admin` on `Sat Dec 16 08:25:46 GMT 2023`
Record UNII	361FSH5XMM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ER-127528

Common Name

English

1H-INDEN-1-ONE, 2-FLUORO-2-((1-((3-FLUOROPHENYL)METHYL)-4-PIPERIDINYL)METHYL)-2,3-DIHYDRO-5,6-DIMETHOXY-, HYDROCHLORIDE

Systematic Name

English

1H-INDEN-1-ONE, 2-FLUORO-2-((1-((3-FLUOROPHENYL)METHYL)-4-PIPERIDINYL)METHYL)-2,3-DIHYDRO-5,6-DIMETHOXY-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

361FSH5XMM

Created by admin on Sat Dec 16 08:25:46 GMT 2023 , Edited by admin on Sat Dec 16 08:25:46 GMT 2023

PRIMARY

CAS

290308-82-6

Created by admin on Sat Dec 16 08:25:46 GMT 2023 , Edited by admin on Sat Dec 16 08:25:46 GMT 2023

PRIMARY

PUBCHEM

10138890

Created by admin on Sat Dec 16 08:25:46 GMT 2023 , Edited by admin on Sat Dec 16 08:25:46 GMT 2023

PRIMARY

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