BOMETOLOL, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H32N2O7
Molecular Weight	472.5308
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(OC)C=C(CCNC[C@H](O)COC2=CC=C(OCC(C)=O)C3=C2CCC(=O)N3)C=C1

InChI

InChIKey=IXJJPGSXJXQFGI-SFHVURJKSA-N

InChI=1S/C25H32N2O7/c1-16(28)14-33-22-8-7-20(19-5-9-24(30)27-25(19)22)34-15-18(29)13-26-11-10-17-4-6-21(31-2)23(12-17)32-3/h4,6-8,12,18,26,29H,5,9-11,13-15H2,1-3H3,(H,27,30)/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H32N2O7
Molecular Weight	472.5308
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:21:11 GMT 2023` Edited by `admin` on `Sat Dec 16 10:21:11 GMT 2023`
Record UNII	52H0FYO1F5
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BOMETOLOL, (S)-

Common Name

English

OPC 1427, (S)-

Code

English

2(1H)-QUINOLINONE, 5-(3-((2-(3,4-DIMETHOXYPHENYL)ETHYL)AMINO)-2-HYDROXYPROPOXY)-3,4-DIHYDRO-8-(2-OXOPROPOXY)-, (S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

12751868

Created by admin on Sat Dec 16 10:21:11 GMT 2023 , Edited by admin on Sat Dec 16 10:21:11 GMT 2023

PRIMARY

CAS

79784-50-2

Created by admin on Sat Dec 16 10:21:11 GMT 2023 , Edited by admin on Sat Dec 16 10:21:11 GMT 2023

PRIMARY

FDA UNII

52H0FYO1F5

Created by admin on Sat Dec 16 10:21:11 GMT 2023 , Edited by admin on Sat Dec 16 10:21:11 GMT 2023

PRIMARY

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BOMETOLOL

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