4-[2-(4-imidazol-1-ylphenyl)-5-(2H-1,2,3,4-tetrazol-5-ylmethyl)pyrrol-1-yl]phenol

Systemtic Name: 4-[2-(4-imidazol-1-ylphenyl)-5-(2H-1,2,3,4-tetrazol-5-ylmethyl)pyrrol-1-yl]phenol Openeye Name: 4-[2-(4-imidazol-1-ylphenyl)-5-(2H-tetrazol-5-ylmethyl)pyrrol-1-yl]phenol CAS Name: 4-[2-[4-(1-imidazolyl)phenyl]-5-(2H-tetrazol-5-ylmethyl)-1-pyrrolyl]phenol IUPAC Name: 4-[2-(4-imidazol-1-ylphenyl)-5-(2H-tetrazol-5-ylmethyl)pyrrol-1-yl]phenol Traditional Name: 4-[2-(4-imidazol-1-ylphenyl)-5-(2H-tetrazol-5-ylmethyl)pyrrol-1-yl]phenol Formula: C21H17N7O MolecularWeight: 383.40598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(N2C3=CC=C(C=C3)O)CC4=NNN=N4)N5C=CN=C5

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(N2C3=CC=C(C=C3)O)CC4=NNN=N4)N5C=CN=C5

InChI

InChI=1S/C21H17N7O/c29-19-8-5-17(6-9-19)28-18(13-21-23-25-26-24-21)7-10-20(28)15-1-3-16(4-2-15)27-12-11-22-14-27/h1-12,14,29H,13H2,(H,23,24,25,26)