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

Systemtic Name: 1-[3-(4-butylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole Openeye Name: 2-(4-benzyloxyphenyl)-1-[3-(4-butylphenoxy)propyl]-5-methyl-pyrrole CAS Name: 1-[3-(4-butylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole IUPAC Name: 1-[3-(4-butylphenoxy)propyl]-2-methyl-5-(4-phenylmethoxyphenyl)pyrrole Traditional Name: 2-(4-benzoxyphenyl)-1-[3-(4-butylphenoxy)propyl]-5-methyl-pyrrole Formula: C31H35NO2 MolecularWeight: 453.6151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)OCCCN2C(=CC=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)OCCCN2C(=CC=C2C3=CC=C(C=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C31H35NO2/c1-3-4-9-26-13-17-29(18-14-26)33-23-8-22-32-25(2)12-21-31(32)28-15-19-30(20-16-28)34-24-27-10-6-5-7-11-27/h5-7,10-21H,3-4,8-9,22-24H2,1-2H3