3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-ETHOXYPHENYL)PIPERIDINE HYDROCHLORIDE, TRANS-(±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H25NO4.ClH
Molecular Weight	391.888
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-ETHOXYPHENYL)PIPERIDINE HYDROCHLORIDE, TRANS-(±)-

Structure Search

SMILES

Cl.CCOC1=CC=C(C=C1)[C@@H]2CCNC[C@H]2COC3=CC=C4OCOC4=C3

InChI

InChIKey=OTEFTGSDHAZDDN-QSVLQNJRSA-N

InChI=1S/C21H25NO4.ClH/c1-2-23-17-5-3-15(4-6-17)19-9-10-22-12-16(19)13-24-18-7-8-20-21(11-18)26-14-25-20;/h3-8,11,16,19,22H,2,9-10,12-14H2,1H3;1H/t16-,19-;/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	C21H25NO4
Molecular Weight	355.4275
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:22:54 GMT 2023` Edited by `admin` on `Sat Dec 16 18:22:54 GMT 2023`
Record UNII	7V85N9R4KQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-ETHOXYPHENYL)PIPERIDINE HYDROCHLORIDE, TRANS-(±)-

Systematic Name

English

PIPERIDINE, 3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-ETHOXYPHENYL)-, HYDROCHLORIDE (1:1), (3R,4S)-REL-

Common Name

English

3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-ETHOXYPHENYL)PIPERIDINE HYDROCHLORIDE, (3R,4S)-REL-

Systematic Name

English

Code System Code Type Description

FDA UNII

7V85N9R4KQ

Created by admin on Sat Dec 16 18:22:54 GMT 2023 , Edited by admin on Sat Dec 16 18:22:54 GMT 2023

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PUBCHEM

71315277

Created by admin on Sat Dec 16 18:22:54 GMT 2023 , Edited by admin on Sat Dec 16 18:22:54 GMT 2023

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CAS

1346597-97-4

Created by admin on Sat Dec 16 18:22:54 GMT 2023 , Edited by admin on Sat Dec 16 18:22:54 GMT 2023

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