6-[5-[2-(3-fluorophenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[5-[2-(3-fluorophenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[5-[2-(3-fluorophenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[5-[2-(3-fluorophenyl)ethyl-methylamino]-1-oxopentyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[5-[2-(3-fluorophenyl)ethyl-methylamino]pentanoyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[5-[2-(3-fluorophenyl)ethyl-methyl-amino]pentanoyl]-4H-1,4-benzoxazin-3-one Formula: C22H25FN2O3 MolecularWeight: 384.443903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25FN2O3/c1-25(12-10-16-5-4-6-18(23)13-16)11-3-2-7-20(26)17-8-9-21-19(14-17)24-22(27)15-28-21/h4-6,8-9,13-14H,2-3,7,10-12,15H2,1H3,(H,24,27)