1-(4-heptylphenyl)-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole

Systemtic Name: 1-(4-heptylphenyl)-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole Openeye Name: 2-(4-benzyloxyphenyl)-1-(4-heptylphenyl)-5-methyl-pyrrole CAS Name: 1-(4-heptylphenyl)-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole IUPAC Name: 1-(4-heptylphenyl)-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole Traditional Name: 2-(4-benzoxyphenyl)-1-(4-heptylphenyl)-5-methyl-pyrrole Formula: C31H35NO MolecularWeight: 437.6157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)N2C(=CC=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C31H35NO/c1-3-4-5-6-8-11-26-15-19-29(20-16-26)32-25(2)14-23-31(32)28-17-21-30(22-18-28)33-24-27-12-9-7-10-13-27/h7,9-10,12-23H,3-6,8,11,24H2,1-2H3