6-[6-[2-(3-fluorophenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[6-[2-(3-fluorophenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[6-[2-(3-fluorophenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[6-[2-(3-fluorophenyl)ethyl-methylamino]-1-oxohexyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[6-[2-(3-fluorophenyl)ethyl-methylamino]hexanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[6-[2-(3-fluorophenyl)ethyl-methyl-amino]hexanoyl]-4H-1,4-benzoxazin-3-one Formula: C23H27FN2O3 MolecularWeight: 398.470483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2)CCC3=CC(=CC=C3)F

Isomeric SMILES

CN(CCCCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2)CCC3=CC(=CC=C3)F

InChI

InChI=1S/C23H27FN2O3/c1-26(13-11-17-6-5-7-19(24)14-17)12-4-2-3-8-21(27)18-9-10-22-20(15-18)25-23(28)16-29-22/h5-7,9-10,14-15H,2-4,8,11-13,16H2,1H3,(H,25,28)