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

Systemtic Name: 2-[3-(4-butylpiperidin-1-yl)-2-methyl-propyl]-6-fluoranyl-4H-1,4-benzoxazin-3-one Openeye Name: 2-[3-(4-butyl-1-piperidyl)-2-methyl-propyl]-6-fluoro-4H-1,4-benzoxazin-3-one CAS Name: 2-[3-(4-butyl-1-piperidinyl)-2-methylpropyl]-6-fluoro-4H-1,4-benzoxazin-3-one IUPAC Name: 2-[3-(4-butylpiperidin-1-yl)-2-methylpropyl]-6-fluoro-4H-1,4-benzoxazin-3-one Traditional Name: 2-[3-(4-butylpiperidino)-2-methyl-propyl]-6-fluoro-4H-1,4-benzoxazin-3-one Formula: C21H31FN2O2 MolecularWeight: 362.481443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)CC(C)CC2C(=O)NC3=C(O2)C=CC(=C3)F

Isomeric SMILES

CCCCC1CCN(CC1)CC(C)CC2C(=O)NC3=C(O2)C=CC(=C3)F

InChI

InChI=1S/C21H31FN2O2/c1-3-4-5-16-8-10-24(11-9-16)14-15(2)12-20-21(25)23-18-13-17(22)6-7-19(18)26-20/h6-7,13,15-16,20H,3-5,8-12,14H2,1-2H3,(H,23,25)