8-[(1R)-1-hydroxy-2-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]ethyl]-6-phenylmethoxy-4H-1,4-benzoxazin-3-one hydrochloride

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H32N2O5.ClH
Molecular Weight	513.025
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 8-[(1R)-1-hydroxy-2-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]ethyl]-6-phenylmethoxy-4H-1,4-benzoxazin-3-one hydrochloride

Structure Search

SMILES

Cl.COC1=CC=C(CC(C)(C)NC[C@H](O)C2=CC(OCC3=CC=CC=C3)=CC4=C2OCC(=O)N4)C=C1

InChI

InChIKey=HYGOICJLNNBLTD-UQIIZPHYSA-N

InChI=1S/C28H32N2O5.ClH/c1-28(2,15-19-9-11-21(33-3)12-10-19)29-16-25(31)23-13-22(34-17-20-7-5-4-6-8-20)14-24-27(23)35-18-26(32)30-24;/h4-14,25,29,31H,15-18H2,1-3H3,(H,30,32);1H/t25-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C28H32N2O5
Molecular Weight	476.5641
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
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 `Wed Apr 02 17:51:30 GMT 2025` Edited by `admin` on `Wed Apr 02 17:51:30 GMT 2025`
Record UNII	7PD84Z2N7G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2H-1,4-Benzoxazin-3(4H)-one, 8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-6-(phenylmethoxy)-, hydrochloride (1:1)

Preferred Name

English

8-[(1R)-1-hydroxy-2-[[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino]ethyl]-6-phenylmethoxy-4H-1,4-benzoxazin-3-one hydrochloride

Systematic Name

English

Code System Code Type Description

FDA UNII

7PD84Z2N7G

Created by admin on Wed Apr 02 17:51:30 GMT 2025 , Edited by admin on Wed Apr 02 17:51:30 GMT 2025

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PUBCHEM

67153138

Created by admin on Wed Apr 02 17:51:30 GMT 2025 , Edited by admin on Wed Apr 02 17:51:30 GMT 2025

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CAS

926319-48-4

Created by admin on Wed Apr 02 17:51:30 GMT 2025 , Edited by admin on Wed Apr 02 17:51:30 GMT 2025

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