[2-(6-hex-1-ynylpyrazin-2-yl)furan-3-yl]phosphonic acid

Systemtic Name: [2-(6-hex-1-ynylpyrazin-2-yl)furan-3-yl]phosphonic acid Openeye Name: [2-(6-hex-1-ynylpyrazin-2-yl)-3-furyl]phosphonic acid CAS Name: [2-(6-hex-1-ynyl-2-pyrazinyl)-3-furanyl]phosphonic acid IUPAC Name: [2-(6-hex-1-ynylpyrazin-2-yl)furan-3-yl]phosphonic acid Traditional Name: [2-(6-hex-1-ynylpyrazin-2-yl)-3-furyl]phosphonic acid Formula: C14H15N2O4P MolecularWeight: 306.253661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CN=CC(=N1)C2=C(C=CO2)P(=O)(O)O

Isomeric SMILES

CCCCC#CC1=CN=CC(=N1)C2=C(C=CO2)P(=O)(O)O

InChI

InChI=1S/C14H15N2O4P/c1-2-3-4-5-6-11-9-15-10-12(16-11)14-13(7-8-20-14)21(17,18)19/h7-10H,2-4H2,1H3,(H2,17,18,19)