6,13-bis(4-methylphenyl)pentacene

Systemtic Name: 6,13-bis(4-methylphenyl)pentacene Openeye Name: 6,13-bis(p-tolyl)pentacene CAS Name: 6,13-bis(4-methylphenyl)pentacene IUPAC Name: 6,13-bis(4-methylphenyl)pentacene Traditional Name: 6,13-bis(p-tolyl)pentacene Formula: C36H26 MolecularWeight: 458.59164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C4C=CC=CC4=CC3=C(C5=CC6=CC=CC=C6C=C52)C7=CC=C(C=C7)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C4C=CC=CC4=CC3=C(C5=CC6=CC=CC=C6C=C52)C7=CC=C(C=C7)C

InChI

InChI=1S/C36H26/c1-23-11-15-25(16-12-23)35-31-19-27-7-3-5-9-29(27)21-33(31)36(26-17-13-24(2)14-18-26)34-22-30-10-6-4-8-28(30)20-32(34)35/h3-22H,1-2H3