7-penta-1,4-diyn-3-ylidenebenzo[a]phenalene

Systemtic Name: 7-penta-1,4-diyn-3-ylidenebenzo[a]phenalene Openeye Name: 7-(1-ethynylprop-2-ynylidene)benzo[a]phenalene CAS Name: 7-penta-1,4-diyn-3-ylidenebenzo[a]phenalene IUPAC Name: 7-penta-1,4-diyn-3-ylidenebenzo[a]phenalene Traditional Name: 7-(1-ethynylprop-2-ynylidene)benzo[a]phenalene Formula: C22H12 MolecularWeight: 276.33068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC(=C1C2=CC=CC=C2C3=CC=CC4=C3C1=CC=C4)C#C

Isomeric SMILES

C#CC(=C1C2=CC=CC=C2C3=CC=CC4=C3C1=CC=C4)C#C

InChI

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