6-(3,5-dimethylpyrazol-1-yl)carbonyl-2-ethyl-4-[(3-fluorophenyl)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)carbonyl-2-ethyl-4-[(3-fluorophenyl)methyl]-1,4-benzoxazin-3-one Openeye Name: 6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-4-[(3-fluorophenyl)methyl]-1,4-benzoxazin-3-one CAS Name: 6-[(3,5-dimethyl-1-pyrazolyl)-oxomethyl]-2-ethyl-4-[(3-fluorophenyl)methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-4-[(3-fluorophenyl)methyl]-1,4-benzoxazin-3-one Traditional Name: 6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-4-(3-fluorobenzyl)-1,4-benzoxazin-3-one Formula: C23H22FN3O3 MolecularWeight: 407.437483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3C(=CC(=N3)C)C)CC4=CC(=CC=C4)F

Isomeric SMILES

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3C(=CC(=N3)C)C)CC4=CC(=CC=C4)F

InChI

InChI=1S/C23H22FN3O3/c1-4-20-23(29)26(13-16-6-5-7-18(24)11-16)19-12-17(8-9-21(19)30-20)22(28)27-15(3)10-14(2)25-27/h5-12,20H,4,13H2,1-3H3