4(1H)-PYRIMIDINIMINE, 1-((6-CHLORO-2H-1-BENZOPYRAN-3-YL)CARBONYL)-

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H11ClN2O2
Molecular Weight	286.713
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4(1H)-PYRIMIDINIMINE, 1-((6-CHLORO-2H-1-BENZOPYRAN-3-YL)CARBONYL)-

Structure Search

SMILES

ClC1=CC2=C(OCC(=C2)C(=O)N3C=CC(=N)C=C3)C=C1

InChI

InChIKey=XMMVIAWVYLIYRR-UHFFFAOYSA-N

InChI=1S/C15H11ClN2O2/c16-12-1-2-14-10(8-12)7-11(9-20-14)15(19)18-5-3-13(17)4-6-18/h1-8,17H,9H2

HIDE SMILES / InChI

Molecular Formula	C15H11ClN2O2
Molecular Weight	286.713
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 20:18:45 GMT 2025` Edited by `admin` on `Tue Apr 01 20:18:45 GMT 2025`
Record UNII	50O4EJ68HP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4(1H)-PYRIMIDINIMINE, 1-((6-CHLORO-2H-1-BENZOPYRAN-3-YL)CARBONYL)-

Systematic Name

English

NSC-147901

Preferred Name

English

METHANONE, (6-CHLORO-2H-1-BENZOPYRAN-3-YL)(4-IMINO-1(4H)-PYRIDINYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

50O4EJ68HP

Created by admin on Tue Apr 01 20:18:45 GMT 2025 , Edited by admin on Tue Apr 01 20:18:45 GMT 2025

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PUBCHEM

98554

Created by admin on Tue Apr 01 20:18:45 GMT 2025 , Edited by admin on Tue Apr 01 20:18:45 GMT 2025

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EPA CompTox

DTXSID00232723

Created by admin on Tue Apr 01 20:18:45 GMT 2025 , Edited by admin on Tue Apr 01 20:18:45 GMT 2025

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CAS

83823-23-8

Created by admin on Tue Apr 01 20:18:45 GMT 2025 , Edited by admin on Tue Apr 01 20:18:45 GMT 2025

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NSC

147901

Created by admin on Tue Apr 01 20:18:45 GMT 2025 , Edited by admin on Tue Apr 01 20:18:45 GMT 2025

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