2-[3-(4-butyl-3-fluoranyl-piperidin-1-yl)-2-methyl-propyl]-6-fluoranyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 2-[3-(4-butyl-3-fluoranyl-piperidin-1-yl)-2-methyl-propyl]-6-fluoranyl-4H-1,4-benzoxazin-3-one Openeye Name: 2-[3-(4-butyl-3-fluoro-1-piperidyl)-2-methyl-propyl]-6-fluoro-4H-1,4-benzoxazin-3-one CAS Name: 2-[3-(4-butyl-3-fluoro-1-piperidinyl)-2-methylpropyl]-6-fluoro-4H-1,4-benzoxazin-3-one IUPAC Name: 2-[3-(4-butyl-3-fluoropiperidin-1-yl)-2-methylpropyl]-6-fluoro-4H-1,4-benzoxazin-3-one Traditional Name: 2-[3-(4-butyl-3-fluoro-piperidino)-2-methyl-propyl]-6-fluoro-4H-1,4-benzoxazin-3-one Formula: C21H30F2N2O2 MolecularWeight: 380.471906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1F)CC(C)CC2C(=O)NC3=C(O2)C=CC(=C3)F

Isomeric SMILES

CCCCC1CCN(CC1F)CC(C)CC2C(=O)NC3=C(O2)C=CC(=C3)F

InChI

InChI=1S/C21H30F2N2O2/c1-3-4-5-15-8-9-25(13-17(15)23)12-14(2)10-20-21(26)24-18-11-16(22)6-7-19(18)27-20/h6-7,11,14-15,17,20H,3-5,8-10,12-13H2,1-2H3,(H,24,26)