3,8-bis(4-methylphenyl)pyrene-1-carbaldehyde

Systemtic Name: 3,8-bis(4-methylphenyl)pyrene-1-carbaldehyde Openeye Name: 3,8-bis(p-tolyl)pyrene-1-carbaldehyde CAS Name: 3,8-bis(4-methylphenyl)-1-pyrenecarboxaldehyde IUPAC Name: 3,8-bis(4-methylphenyl)pyrene-1-carbaldehyde Traditional Name: 3,8-bis(p-tolyl)pyrene-1-carbaldehyde Formula: C31H22O MolecularWeight: 410.50578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CC4=C(C=C(C5=C4C3=C(C=C2)C=C5)C6=CC=C(C=C6)C)C=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CC4=C(C=C(C5=C4C3=C(C=C2)C=C5)C6=CC=C(C=C6)C)C=O

InChI

InChI=1S/C31H22O/c1-19-3-7-21(8-4-19)25-13-11-23-12-14-28-29(22-9-5-20(2)6-10-22)17-24(18-32)26-15-16-27(25)30(23)31(26)28/h3-18H,1-2H3