1-(3,3,5-triphenylpyrrol-2-yl)isoquinoline

Systemtic Name: 1-(3,3,5-triphenylpyrrol-2-yl)isoquinoline Openeye Name: 1-(3,3,5-triphenylpyrrol-2-yl)isoquinoline CAS Name: 1-(3,3,5-triphenyl-2-pyrrolyl)isoquinoline IUPAC Name: 1-(3,3,5-triphenylpyrrol-2-yl)isoquinoline Traditional Name: 1-(3,3,5-triphenylpyrrol-2-yl)isoquinoline Formula: C31H22N2 MolecularWeight: 422.51978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(C(=N2)C3=NC=CC4=CC=CC=C43)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(C(=N2)C3=NC=CC4=CC=CC=C43)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H22N2/c1-4-13-24(14-5-1)28-22-31(25-15-6-2-7-16-25,26-17-8-3-9-18-26)30(33-28)29-27-19-11-10-12-23(27)20-21-32-29/h1-22H