METHYL 7,8-BIS(ACETYLOXY)-3-ISOQUINOLINECARBOXYLATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H13NO6
Molecular Weight	303.2668
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYL 7,8-BIS(ACETYLOXY)-3-ISOQUINOLINECARBOXYLATE

Structure Search

SMILES

COC(=O)C1=NC=C2C(C=CC(OC(C)=O)=C2OC(C)=O)=C1

InChI

InChIKey=IPAJXTAZSRNPTR-UHFFFAOYSA-N

InChI=1S/C15H13NO6/c1-8(17)21-13-5-4-10-6-12(15(19)20-3)16-7-11(10)14(13)22-9(2)18/h4-7H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C15H13NO6
Molecular Weight	303.2668
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 `Tue Apr 01 19:30:14 GMT 2025` Edited by `admin` on `Tue Apr 01 19:30:14 GMT 2025`
Record UNII	M3EJU8X3MA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

METHYL 7,8-BIS(ACETYLOXY)-3-ISOQUINOLINECARBOXYLATE

Systematic Name

English

NSC-655249

Preferred Name

English

3-ISOQUINOLINECARBOXYLIC ACID, 7,8-BIS(ACETYLOXY)-, METHYL ESTER

Systematic Name

English

Code System Code Type Description

NSC

655249

Created by admin on Tue Apr 01 19:30:14 GMT 2025 , Edited by admin on Tue Apr 01 19:30:14 GMT 2025

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PUBCHEM

375465

Created by admin on Tue Apr 01 19:30:14 GMT 2025 , Edited by admin on Tue Apr 01 19:30:14 GMT 2025

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EPA CompTox

DTXSID80162195

Created by admin on Tue Apr 01 19:30:14 GMT 2025 , Edited by admin on Tue Apr 01 19:30:14 GMT 2025

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FDA UNII

M3EJU8X3MA

Created by admin on Tue Apr 01 19:30:14 GMT 2025 , Edited by admin on Tue Apr 01 19:30:14 GMT 2025

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CAS

142822-86-4

Created by admin on Tue Apr 01 19:30:14 GMT 2025 , Edited by admin on Tue Apr 01 19:30:14 GMT 2025

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