4-azanyl-4-fluoranyl-5-methyl-6-(3-pyridin-3-ylpropyl)-1,3-benzoxazol-2-one

Systemtic Name: 4-azanyl-4-fluoranyl-5-methyl-6-(3-pyridin-3-ylpropyl)-1,3-benzoxazol-2-one Openeye Name: 4-amino-4-fluoro-5-methyl-6-[3-(3-pyridyl)propyl]-1,3-benzoxazol-2-one CAS Name: 4-amino-4-fluoro-5-methyl-6-[3-(3-pyridinyl)propyl]-1,3-benzoxazol-2-one IUPAC Name: 4-amino-4-fluoro-5-methyl-6-(3-pyridin-3-ylpropyl)-1,3-benzoxazol-2-one Traditional Name: 4-amino-4-fluoro-5-methyl-6-[3-(3-pyridyl)propyl]-1,3-benzoxazol-2-one Formula: C16H16FN3O2 MolecularWeight: 301.315543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=NC(=O)O2)C1(N)F)CCCC3=CN=CC=C3

Isomeric SMILES

CC1=C(C=C2C(=NC(=O)O2)C1(N)F)CCCC3=CN=CC=C3

InChI

InChI=1S/C16H16FN3O2/c1-10-12(6-2-4-11-5-3-7-19-9-11)8-13-14(16(10,17)18)20-15(21)22-13/h3,5,7-9H,2,4,6,18H2,1H3