4-[5-(1H-benzimidazol-2-yl)-3-(4-methylphenyl)-2-pentyl-pyrrol-1-yl]phenol

Systemtic Name: 4-[5-(1H-benzimidazol-2-yl)-3-(4-methylphenyl)-2-pentyl-pyrrol-1-yl]phenol Openeye Name: 4-[5-(1H-benzimidazol-2-yl)-2-pentyl-3-(p-tolyl)pyrrol-1-yl]phenol CAS Name: 4-[5-(1H-benzimidazol-2-yl)-3-(4-methylphenyl)-2-pentyl-1-pyrrolyl]phenol IUPAC Name: 4-[5-(1H-benzimidazol-2-yl)-3-(4-methylphenyl)-2-pentylpyrrol-1-yl]phenol Traditional Name: 4-[2-amyl-5-(1H-benzimidazol-2-yl)-3-(p-tolyl)pyrrol-1-yl]phenol Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(N1C2=CC=C(C=C2)O)C3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCCC1=C(C=C(N1C2=CC=C(C=C2)O)C3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)C

InChI

InChI=1S/C29H29N3O/c1-3-4-5-10-27-24(21-13-11-20(2)12-14-21)19-28(32(27)22-15-17-23(33)18-16-22)29-30-25-8-6-7-9-26(25)31-29/h6-9,11-19,33H,3-5,10H2,1-2H3,(H,30,31)