1-[2-oxidanyl-3-propyl-4-[9-(2H-1,2,3,4-tetrazol-5-yl)nonoxy]phenyl]ethanone

Systemtic Name: 1-[2-oxidanyl-3-propyl-4-[9-(2H-1,2,3,4-tetrazol-5-yl)nonoxy]phenyl]ethanone Openeye Name: 1-[2-hydroxy-3-propyl-4-[9-(2H-tetrazol-5-yl)nonoxy]phenyl]ethanone CAS Name: 1-[2-hydroxy-3-propyl-4-[9-(2H-tetrazol-5-yl)nonoxy]phenyl]ethanone IUPAC Name: 1-[2-hydroxy-3-propyl-4-[9-(2H-tetrazol-5-yl)nonoxy]phenyl]ethanone Traditional Name: 1-[2-hydroxy-3-propyl-4-[9-(2H-tetrazol-5-yl)nonoxy]phenyl]ethanone Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCCCCC2=NNN=N2

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCCCCC2=NNN=N2

InChI

InChI=1S/C21H32N4O3/c1-3-11-18-19(14-13-17(16(2)26)21(18)27)28-15-10-8-6-4-5-7-9-12-20-22-24-25-23-20/h13-14,27H,3-12,15H2,1-2H3,(H,22,23,24,25)