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

Systemtic Name: 1-(4-methylphenyl)-3-octyl-2,5-diphenyl-pyrrole Openeye Name: 3-octyl-2,5-diphenyl-1-(p-tolyl)pyrrole CAS Name: 1-(4-methylphenyl)-3-octyl-2,5-diphenylpyrrole IUPAC Name: 1-(4-methylphenyl)-3-octyl-2,5-diphenylpyrrole Traditional Name: 3-octyl-2,5-diphenyl-1-(p-tolyl)pyrrole Formula: C31H35N MolecularWeight: 421.6163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCC1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C31H35N/c1-3-4-5-6-7-10-19-28-24-30(26-15-11-8-12-16-26)32(29-22-20-25(2)21-23-29)31(28)27-17-13-9-14-18-27/h8-9,11-18,20-24H,3-7,10,19H2,1-2H3