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1-[2-bromanyl-3-methyl-4-[4-(2H-1,2,3,4-tetrazol-5-yl)butoxymethyl]phenyl]butan-2-one

1-[2-bromanyl-3-methyl-4-[4-(2H-1,2,3,4-tetrazol-5-yl)butoxymethyl]phenyl]butan-2-one

Systemtic Name:1-[2-bromanyl-3-methyl-4-[4-(2H-1,2,3,4-tetrazol-5-yl)butoxymethyl]phenyl]butan-2-one
Openeye Name:1-[2-bromo-3-methyl-4-[4-(2H-tetrazol-5-yl)butoxymethyl]phenyl]butan-2-one
CAS Name:1-[2-bromo-3-methyl-4-[4-(2H-tetrazol-5-yl)butoxymethyl]phenyl]-2-butanone
IUPAC Name:1-[2-bromo-3-methyl-4-[4-(2H-tetrazol-5-yl)butoxymethyl]phenyl]butan-2-one
Traditional Name:1-[2-bromo-3-methyl-4-[4-(2H-tetrazol-5-yl)butoxymethyl]phenyl]butan-2-one
Formula: C17H23BrN4O2
MolecularWeight: 395.29412
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1=C(C(=C(C=C1)COCCCCC2=NNN=N2)C)Br


Isomeric SMILES

CCC(=O)CC1=C(C(=C(C=C1)COCCCCC2=NNN=N2)C)Br


InChI

InChI=1S/C17H23BrN4O2/c1-3-15(23)10-13-7-8-14(12(2)17(13)18)11-24-9-5-4-6-16-19-21-22-20-16/h7-8H,3-6,9-11H2,1-2H3,(H,19,20,21,22)


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