4-[2-[4-(5-methoxy-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[4-(5-methoxy-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-[4-(2-hydroxy-5-methoxy-benzoyl)pyrazol-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-[4-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-1-pyrazolyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[4-(2-hydroxy-5-methoxybenzoyl)pyrazol-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-[4-(2-hydroxy-5-methoxy-benzoyl)pyrazol-1-yl]-2-keto-ethyl]-1,4-benzoxazin-3-one Formula: C21H17N3O6 MolecularWeight: 407.37618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)C2=CN(N=C2)C(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)C2=CN(N=C2)C(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C21H17N3O6/c1-29-14-6-7-17(25)15(8-14)21(28)13-9-22-24(10-13)19(26)11-23-16-4-2-3-5-18(16)30-12-20(23)27/h2-10,25H,11-12H2,1H3