2-[[3-[3-phenyl-4-(2H-1,2,3,4-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline

Systemtic Name: 2-[[3-[3-phenyl-4-(2H-1,2,3,4-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline Openeye Name: 2-[[3-[3-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline CAS Name: 2-[[3-[3-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline IUPAC Name: 2-[[3-[3-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline Traditional Name: 2-[[3-[3-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline Formula: C27H25N5O MolecularWeight: 435.5203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=NNN=N5

Isomeric SMILES

C1=CC=C(C=C1)C(CCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=NNN=N5

InChI

InChI=1S/C27H25N5O/c1-2-8-21(9-3-1)23(18-27-29-31-32-30-27)14-13-20-7-6-11-25(17-20)33-19-24-16-15-22-10-4-5-12-26(22)28-24/h1-12,15-17,23H,13-14,18-19H2,(H,29,30,31,32)