CJ-17493 DIHYDROCHLORIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H29F3N2O2.2ClH
Molecular Weight	507.416
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.Cl.COC1=C(CN[C@H]2CCCN[C@H]2C3=CC=CC=C3)C=C4C(CCO[C@@]4(C)C(F)(F)F)=C1

InChI

InChIKey=KKNJXTXCALOALI-DYPVWFCVSA-N

InChI=1S/C24H29F3N2O2.2ClH/c1-23(24(25,26)27)19-13-18(21(30-2)14-17(19)10-12-31-23)15-29-20-9-6-11-28-22(20)16-7-4-3-5-8-16;;/h3-5,7-8,13-14,20,22,28-29H,6,9-12,15H2,1-2H3;2*1H/t20-,22-,23+;;/m0../s1

HIDE SMILES / InChI

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

Molecular Formula	C24H29F3N2O2
Molecular Weight	434.4945
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:55:55 GMT 2023` Edited by `admin` on `Fri Dec 15 15:55:55 GMT 2023`
Record UNII	PV5Z1QZI62
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CJ-17493 DIHYDROCHLORIDE

Code

English

3-PIPERIDINAMINE, N-(((1R)-3,4-DIHYDRO-6-METHOXY-1-METHYL-1-(TRIFLUOROMETHYL)-1H-2-BENZOPYRAN-7-YL)METHYL)-2-PHENYL-, HYDROCHLORIDE (1:2), (2S,3S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

PV5Z1QZI62

Created by admin on Fri Dec 15 15:55:55 GMT 2023 , Edited by admin on Fri Dec 15 15:55:55 GMT 2023

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CAS

225526-03-4

Created by admin on Fri Dec 15 15:55:55 GMT 2023 , Edited by admin on Fri Dec 15 15:55:55 GMT 2023

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PUBCHEM

20657917

Created by admin on Fri Dec 15 15:55:55 GMT 2023 , Edited by admin on Fri Dec 15 15:55:55 GMT 2023

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