1-(1,3-benzoxazol-2-yl)-3-ethyl-heptan-2-one

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-3-ethyl-heptan-2-one Openeye Name: 1-(1,3-benzoxazol-2-yl)-3-ethyl-heptan-2-one CAS Name: 1-(1,3-benzoxazol-2-yl)-3-ethyl-2-heptanone IUPAC Name: 1-(1,3-benzoxazol-2-yl)-3-ethylheptan-2-one Traditional Name: 1-(1,3-benzoxazol-2-yl)-3-ethyl-heptan-2-one Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)CC1=NC2=CC=CC=C2O1

Isomeric SMILES

CCCCC(CC)C(=O)CC1=NC2=CC=CC=C2O1

InChI

InChI=1S/C16H21NO2/c1-3-5-8-12(4-2)14(18)11-16-17-13-9-6-7-10-15(13)19-16/h6-7,9-10,12H,3-5,8,11H2,1-2H3