N-[4-bromanyl-5-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-2-methyl-phenyl]-2H-1,2,3,4-tetrazole-5-carboxamide

Systemtic Name: N-[4-bromanyl-5-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-2-methyl-phenyl]-2H-1,2,3,4-tetrazole-5-carboxamide Openeye Name: N-[5-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-4-bromo-2-methyl-phenyl]-2H-tetrazole-5-carboxamide CAS Name: N-[5-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-bromo-2-methylphenyl]-2H-tetrazole-5-carboxamide IUPAC Name: N-[5-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-4-bromo-2-methylphenyl]-2H-tetrazole-5-carboxamide Traditional Name: N-[5-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-4-bromo-2-methyl-phenyl]-2H-tetrazole-5-carboxamide Formula: C23H26BrN5O6 MolecularWeight: 548.38644

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=C(C=C(C(=C2)NC(=O)C3=NNN=N3)C)Br)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=C(C=C(C(=C2)NC(=O)C3=NNN=N3)C)Br)O

InChI

InChI=1S/C23H26BrN5O6/c1-4-5-16-19(7-6-15(13(3)30)21(16)32)34-10-14(31)11-35-20-9-18(12(2)8-17(20)24)25-23(33)22-26-28-29-27-22/h6-9,14,31-32H,4-5,10-11H2,1-3H3,(H,25,33)(H,26,27,28,29)