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

Systemtic Name: 2-[[4-[5-phenyl-4-(2H-1,2,3,4-tetrazol-5-yl)pentyl]phenoxy]methyl]quinoline Openeye Name: 2-[[4-[5-phenyl-4-(2H-tetrazol-5-yl)pentyl]phenoxy]methyl]quinoline CAS Name: 2-[[4-[5-phenyl-4-(2H-tetrazol-5-yl)pentyl]phenoxy]methyl]quinoline IUPAC Name: 2-[[4-[5-phenyl-4-(2H-tetrazol-5-yl)pentyl]phenoxy]methyl]quinoline Traditional Name: 2-[[4-[5-phenyl-4-(2H-tetrazol-5-yl)pentyl]phenoxy]methyl]quinoline Formula: C28H27N5O MolecularWeight: 449.54688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27N5O/c1-2-7-22(8-3-1)19-24(28-30-32-33-31-28)11-6-9-21-13-17-26(18-14-21)34-20-25-16-15-23-10-4-5-12-27(23)29-25/h1-5,7-8,10,12-18,24H,6,9,11,19-20H2,(H,30,31,32,33)