1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL)PHENOXY)-2-PROPANOL

Details

Stereochemistry	MIXED
Molecular Formula	C31H39NO4
Molecular Weight	489.6457
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL)PHENOXY)-2-PROPANOL

Structure Search

SMILES

CCCCNCC(O)COC1=CC=C(C=C1)C2C(C3=CC=CC=C3)C(C)(C)OC4=C2C=CC(OC)=C4

InChI

InChIKey=DPUSZFCOUVEVOU-UHFFFAOYSA-N

InChI=1S/C31H39NO4/c1-5-6-18-32-20-24(33)21-35-25-14-12-22(13-15-25)29-27-17-16-26(34-4)19-28(27)36-31(2,3)30(29)23-10-8-7-9-11-23/h7-17,19,24,29-30,32-33H,5-6,18,20-21H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C31H39NO4
Molecular Weight	489.6457
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:51:16 GMT 2025` Edited by `admin` on `Mon Mar 31 21:51:16 GMT 2025`
Record UNII	F994LS0ISO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-PROPANOL, 1-(BUTYLAMINO)-3-(4-(3,4-DIHYDRO-7-METHOXY-2,2-DIMETHYL-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-

Preferred Name

English

1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-3,4-DIHYDRO-2H-1-BENZOPYRAN-4-YL)PHENOXY)-2-PROPANOL

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30911317

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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CAS

109736-12-1

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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FDA UNII

F994LS0ISO

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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PUBCHEM

3066200

Created by admin on Mon Mar 31 21:51:16 GMT 2025 , Edited by admin on Mon Mar 31 21:51:16 GMT 2025

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