1-(2H-1-Benzopyran-3-ylcarbonyl)-4(1H)-pyridinimine

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Basic information

CAS: 83823-13-6
Standard SMILES: N=c1ccn(C(=O)C2=Cc3ccccc3OC2)cc1
InChIKey: GSPKLAZUVYHGOK-UHFFFAOYSA-N
Molecular formula: C15H12N2O2
Average molar mass: 252.27 g/mol
Monoisotopic mass: 252.08987763

Names & identifiers

Preferred name: 1-(2H-1-Benzopyran-3-ylcarbonyl)-4(1H)-pyridinimine
IUPAC: 2H-chromen-3-yl-(4-imino-1-pyridinyl)methanone

Names & synonyms

4(1H)-Pyridinimine, 1-(2H-1-benzopyran-3-ylcarbonyl)-83823-13-6NSC 147904BRN 447350469WJY02XI91-(2H-1-Benzopyran-3-ylcarbonyl)-4(1H)-pyridinimineNSC-147904UNII-69WJY02XI9DTXSID50232718METHANONE, 2H-1-BENZOPYRAN-3-YL(4-IMINO-1(4H)-PYRIDINYL)-RefChem:196921DTXCID80155209

Show more names

NSC147904(2H-1-Benzopyran-3-yl)(4-iminopyridin-1(4H)-yl)methanone

Database identifiers

CAS: 83823-13-6
PubChem CID: 98556
DTXSID: DTXSID50232718
UNII: 69WJY02XI9

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 53.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 19
Formal charge: 0
Complexity: 474

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Compound notes

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