(1-ethynylpyren-2-yl)-phenyl-methanone

Systemtic Name: (1-ethynylpyren-2-yl)-phenyl-methanone Openeye Name: (1-ethynylpyren-2-yl)-phenyl-methanone CAS Name: (1-ethynyl-2-pyrenyl)-phenylmethanone IUPAC Name: (1-ethynylpyren-2-yl)-phenylmethanone Traditional Name: (1-ethynylpyren-2-yl)-phenyl-methanone Formula: C25H14O MolecularWeight: 330.37806

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(C=C2C=CC3=C4C2=C1C=CC4=CC=C3)C(=O)C5=CC=CC=C5

Isomeric SMILES

C#CC1=C(C=C2C=CC3=C4C2=C1C=CC4=CC=C3)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H14O/c1-2-20-21-14-13-17-10-6-9-16-11-12-19(24(21)23(16)17)15-22(20)25(26)18-7-4-3-5-8-18/h1,3-15H