1-(5-methylcyclopenta-1,4-dien-1-yl)pyrene

Systemtic Name: 1-(5-methylcyclopenta-1,4-dien-1-yl)pyrene Openeye Name: 1-(5-methylcyclopenta-1,4-dien-1-yl)pyrene CAS Name: 1-(5-methyl-1-cyclopenta-1,4-dienyl)pyrene IUPAC Name: 1-(5-methylcyclopenta-1,4-dien-1-yl)pyrene Traditional Name: 1-(5-methylcyclopenta-1,4-dien-1-yl)pyrene Formula: C22H16 MolecularWeight: 280.36244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC=C1C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

Isomeric SMILES

CC1=CCC=C1C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

InChI

InChI=1S/C22H16/c1-14-4-2-7-18(14)19-12-10-17-9-8-15-5-3-6-16-11-13-20(19)22(17)21(15)16/h3-13H,2H2,1H3