Ethyl 3-(4-chlorophenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-carboxylate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H13ClO6
Molecular Weight	360.745
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 3-(4-chlorophenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-carboxylate

Structure Search

SMILES

CCOC(=O)C1=C(C(=O)C2=C(O)C=C(O)C=C2O1)C3=CC=C(Cl)C=C3

InChI

InChIKey=KWQNFLZAEPQQJA-UHFFFAOYSA-N

InChI=1S/C18H13ClO6/c1-2-24-18(23)17-14(9-3-5-10(19)6-4-9)16(22)15-12(21)7-11(20)8-13(15)25-17/h3-8,20-21H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula	C18H13ClO6
Molecular Weight	360.745
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 10:03:30 GMT 2023` Edited by `admin` on `Sat Dec 16 10:03:30 GMT 2023`
Record UNII	SVG4EX6X7S
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Ethyl 3-(4-chlorophenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-carboxylate

Systematic Name

English

3-(p-Chlorophenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-2-carboxylic acid ethyl ester

Systematic Name

English

4H-1-Benzopyran-2-carboxylic acid, 3-(p-chlorophenyl)-5,7-dihydroxy-4-oxo-, ethyl ester

Systematic Name

English

ethyl 3-(4-chlorophenyl)-5,7-dihydroxy-4-oxochromene-2-carboxylate

Systematic Name

English

4H-1-Benzopyran-2-carboxylic acid, 3-(4-chlorophenyl)-5,7-dihydroxy-4-oxo-, ethyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

5360403

Created by admin on Sat Dec 16 10:03:30 GMT 2023 , Edited by admin on Sat Dec 16 10:03:30 GMT 2023

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EPA CompTox

DTXSID80156317

Created by admin on Sat Dec 16 10:03:30 GMT 2023 , Edited by admin on Sat Dec 16 10:03:30 GMT 2023

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CAS

13004-40-5

Created by admin on Sat Dec 16 10:03:30 GMT 2023 , Edited by admin on Sat Dec 16 10:03:30 GMT 2023

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FDA UNII

SVG4EX6X7S

Created by admin on Sat Dec 16 10:03:30 GMT 2023 , Edited by admin on Sat Dec 16 10:03:30 GMT 2023

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