1-[4-[7-(3-methyl-1,2-oxazol-5-yl)heptoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[7-(3-methyl-1,2-oxazol-5-yl)heptoxy]phenyl]propan-1-one Openeye Name: 1-[4-[7-(3-methylisoxazol-5-yl)heptoxy]phenyl]propan-1-one CAS Name: 1-[4-[7-(3-methyl-5-isoxazolyl)heptoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[7-(3-methyl-1,2-oxazol-5-yl)heptoxy]phenyl]propan-1-one Traditional Name: 1-[4-[7-(3-methylisoxazol-5-yl)heptoxy]phenyl]propan-1-one Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCCCCCCCC2=CC(=NO2)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCCCCCCCC2=CC(=NO2)C

InChI

InChI=1S/C20H27NO3/c1-3-20(22)17-10-12-18(13-11-17)23-14-8-6-4-5-7-9-19-15-16(2)21-24-19/h10-13,15H,3-9,14H2,1-2H3