6-chloranyl-7-(2-ethylhexanoyl)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-7-(2-ethylhexanoyl)-4H-1,4-benzoxazin-3-one Openeye Name: 6-chloro-7-(2-ethylhexanoyl)-4H-1,4-benzoxazin-3-one CAS Name: 6-chloro-7-(2-ethyl-1-oxohexyl)-4H-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-7-(2-ethylhexanoyl)-4H-1,4-benzoxazin-3-one Traditional Name: 6-chloro-7-(2-ethylhexanoyl)-4H-1,4-benzoxazin-3-one Formula: C16H20ClNO3 MolecularWeight: 309.7879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)C1=CC2=C(C=C1Cl)NC(=O)CO2

Isomeric SMILES

CCCCC(CC)C(=O)C1=CC2=C(C=C1Cl)NC(=O)CO2

InChI

InChI=1S/C16H20ClNO3/c1-3-5-6-10(4-2)16(20)11-7-14-13(8-12(11)17)18-15(19)9-21-14/h7-8,10H,3-6,9H2,1-2H3,(H,18,19)