3-ethynylperylene

Systemtic Name: 3-ethynylperylene Openeye Name: 3-ethynylperylene CAS Name: 3-ethynylperylene IUPAC Name: 3-ethynylperylene Traditional Name: 3-ethynylperylene Formula: C22H12 MolecularWeight: 276.33068

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC5=C4C3=CC=C5

Isomeric SMILES

C#CC1=C2C=CC=C3C2=C(C=C1)C4=CC=CC5=C4C3=CC=C5

InChI

InChI=1S/C22H12/c1-2-14-12-13-20-18-10-4-7-15-6-3-9-17(21(15)18)19-11-5-8-16(14)22(19)20/h1,3-13H