1-(3-methylcyclopenta-1,4-dien-1-yl)pyrene

Systemtic Name: 1-(3-methylcyclopenta-1,4-dien-1-yl)pyrene Openeye Name: 1-(3-methylcyclopenta-1,4-dien-1-yl)pyrene CAS Name: 1-(3-methyl-1-cyclopenta-1,4-dienyl)pyrene IUPAC Name: 1-(3-methylcyclopenta-1,4-dien-1-yl)pyrene Traditional Name: 1-(3-methylcyclopenta-1,4-dien-1-yl)pyrene Formula: C22H16 MolecularWeight: 280.36244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(=C1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

Isomeric SMILES

CC1C=CC(=C1)C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

InChI

InChI=1S/C22H16/c1-14-5-6-18(13-14)19-11-9-17-8-7-15-3-2-4-16-10-12-20(19)22(17)21(15)16/h2-14H,1H3