1-(4-methylphenyl)-3,4-dioctyl-2,5-diphenyl-pyrrole

Systemtic Name: 1-(4-methylphenyl)-3,4-dioctyl-2,5-diphenyl-pyrrole Openeye Name: 3,4-dioctyl-2,5-diphenyl-1-(p-tolyl)pyrrole CAS Name: 1-(4-methylphenyl)-3,4-dioctyl-2,5-diphenylpyrrole IUPAC Name: 1-(4-methylphenyl)-3,4-dioctyl-2,5-diphenylpyrrole Traditional Name: 3,4-dioctyl-2,5-diphenyl-1-(p-tolyl)pyrrole Formula: C39H51N MolecularWeight: 533.82894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N(C(=C1CCCCCCCC)C2=CC=CC=C2)C3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCC1=C(N(C(=C1CCCCCCCC)C2=CC=CC=C2)C3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C39H51N/c1-4-6-8-10-12-20-26-36-37(27-21-13-11-9-7-5-2)39(34-24-18-15-19-25-34)40(35-30-28-32(3)29-31-35)38(36)33-22-16-14-17-23-33/h14-19,22-25,28-31H,4-13,20-21,26-27H2,1-3H3