2-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]-1-phenyl-2-(2H-1,2,3,4-tetrazol-5-yl)ethanone

Systemtic Name: 2-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methoxy]-1-phenyl-2-(2H-1,2,3,4-tetrazol-5-yl)ethanone Openeye Name: 2-[(4-acetyl-3-hydroxy-2-propyl-phenyl)methoxy]-1-phenyl-2-(2H-tetrazol-5-yl)ethanone CAS Name: 2-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]-1-phenyl-2-(2H-tetrazol-5-yl)ethanone IUPAC Name: 2-[(4-acetyl-3-hydroxy-2-propylphenyl)methoxy]-1-phenyl-2-(2H-tetrazol-5-yl)ethanone Traditional Name: 2-(4-acetyl-3-hydroxy-2-propyl-benzyl)oxy-1-phenyl-2-(2H-tetrazol-5-yl)ethanone Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)COC(C2=NNN=N2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)COC(C2=NNN=N2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O4/c1-3-7-17-15(10-11-16(13(2)26)19(17)28)12-29-20(21-22-24-25-23-21)18(27)14-8-5-4-6-9-14/h4-6,8-11,20,28H,3,7,12H2,1-2H3,(H,22,23,24,25)