ORMELOXIFENE HYDROCHLORIDE, CIS-

Details

Stereochemistry	RACEMIC
Molecular Formula	C30H35NO3.ClH
Molecular Weight	494.065
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ORMELOXIFENE HYDROCHLORIDE, CIS-

Structure Search

SMILES

Cl.COC1=CC2=C(C=C1)[C@@H]([C@H](C3=CC=CC=C3)C(C)(C)O2)C4=CC=C(OCCN5CCCC5)C=C4

InChI

InChIKey=ZRGUGBSQWQXLHB-OCPPCWRMSA-N

InChI=1S/C30H35NO3.ClH/c1-30(2)29(23-9-5-4-6-10-23)28(26-16-15-25(32-3)21-27(26)34-30)22-11-13-24(14-12-22)33-20-19-31-17-7-8-18-31;/h4-6,9-16,21,28-29H,7-8,17-20H2,1-3H3;1H/t28-,29-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C30H35NO3
Molecular Weight	457.6038
Charge	0
Count

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

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 10:41:12 GMT 2023` Edited by `admin` on `Sat Dec 16 10:41:12 GMT 2023`
Record UNII	JFJ9VA7B3G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ORMELOXIFENE HYDROCHLORIDE, CIS-

Common Name

English

PYRROLIDINE, 1-(2-(4-(3,4-DIHYDRO-7-METHOXY-2,2-DIMETHYL-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)ETHYL)-, HYDROCHLORIDE, CIS-

Systematic Name

English

CIS-2,2-DIMETHYL-3-PHENYL-4-P-(.BETA.-PYRROLIDINOETHOXY)PHENYL-7-METHOXYCHROMAN HYDROCHLORIDE

Common Name

English

Code System Code Type Description

PUBCHEM

71405045

Created by admin on Sat Dec 16 10:41:12 GMT 2023 , Edited by admin on Sat Dec 16 10:41:12 GMT 2023

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CAS

51423-19-9

Created by admin on Sat Dec 16 10:41:12 GMT 2023 , Edited by admin on Sat Dec 16 10:41:12 GMT 2023

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FDA UNII

JFJ9VA7B3G

Created by admin on Sat Dec 16 10:41:12 GMT 2023 , Edited by admin on Sat Dec 16 10:41:12 GMT 2023

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