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

Systemtic Name: 2-[[3-[4-phenyl-4-(2H-1,2,3,4-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline Openeye Name: 2-[[3-[4-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline CAS Name: 2-[[3-[4-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline IUPAC Name: 2-[[3-[4-phenyl-4-(2H-tetrazol-5-yl)butyl]phenoxy]methyl]quinoline Traditional Name: 2-[[3-[4-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(CCCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)C5=NNN=N5

Isomeric SMILES

C1=CC=C(C=C1)C(CCCC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)C5=NNN=N5

InChI

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