2-phenethyl-2-propyl-3-[4-(2H-1,2,3,4-tetrazol-5-yl)phenoxy]-3H-1-benzofuran-5-ol

Systemtic Name: 2-phenethyl-2-propyl-3-[4-(2H-1,2,3,4-tetrazol-5-yl)phenoxy]-3H-1-benzofuran-5-ol Openeye Name: 2-phenethyl-2-propyl-3-[4-(2H-tetrazol-5-yl)phenoxy]-3H-benzofuran-5-ol CAS Name: 2-phenethyl-2-propyl-3-[4-(2H-tetrazol-5-yl)phenoxy]-3H-benzofuran-5-ol IUPAC Name: 2-phenethyl-2-propyl-3-[4-(2H-tetrazol-5-yl)phenoxy]-3H-1-benzofuran-5-ol Traditional Name: 2-phenethyl-2-propyl-3-[4-(2H-tetrazol-5-yl)phenoxy]coumaran-5-ol Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(C2=C(O1)C=CC(=C2)O)OC3=CC=C(C=C3)C4=NNN=N4)CCC5=CC=CC=C5

Isomeric SMILES

CCCC1(C(C2=C(O1)C=CC(=C2)O)OC3=CC=C(C=C3)C4=NNN=N4)CCC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O3/c1-2-15-26(16-14-18-6-4-3-5-7-18)24(22-17-20(31)10-13-23(22)33-26)32-21-11-8-19(9-12-21)25-27-29-30-28-25/h3-13,17,24,31H,2,14-16H2,1H3,(H,27,28,29,30)