1-[3-(4-hexylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole

Systemtic Name: 1-[3-(4-hexylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole Openeye Name: 2-(4-benzyloxyphenyl)-1-[3-(4-hexylphenoxy)propyl]-5-methyl-pyrrole CAS Name: 1-[3-(4-hexylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole IUPAC Name: 1-[3-(4-hexylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole Traditional Name: 2-(4-benzoxyphenyl)-1-[3-(4-hexylphenoxy)propyl]-5-methyl-pyrrole Formula: C33H39NO2 MolecularWeight: 481.66826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)OCCCN2C(=CC=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)OCCCN2C(=CC=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C33H39NO2/c1-3-4-5-7-11-28-15-19-31(20-16-28)35-25-10-24-34-27(2)14-23-33(34)30-17-21-32(22-18-30)36-26-29-12-8-6-9-13-29/h6,8-9,12-23H,3-5,7,10-11,24-26H2,1-2H3