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4,5-dipropyl-1H-2-benzoxepin-3-one

4,5-dipropyl-1H-2-benzoxepin-3-one

Systemtic Name:4,5-dipropyl-1H-2-benzoxepin-3-one
Openeye Name:4,5-dipropyl-1H-2-benzoxepin-3-one
CAS Name:4,5-dipropyl-1H-2-benzoxepin-3-one
IUPAC Name:4,5-dipropyl-1H-2-benzoxepin-3-one
Traditional Name:4,5-dipropyl-1H-2-benzoxepin-3-one
Formula: C16H20O2
MolecularWeight: 244.3288
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)OCC2=CC=CC=C21)CCC


Isomeric SMILES

CCCC1=C(C(=O)OCC2=CC=CC=C21)CCC


InChI

InChI=1S/C16H20O2/c1-3-7-14-13-10-6-5-9-12(13)11-18-16(17)15(14)8-4-2/h5-6,9-10H,3-4,7-8,11H2,1-2H3


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