6-[[5-bromanyl-3-(2-phenylpyrazol-3-yl)-1-benzofuran-2-yl]carbonyl]-4-methyl-1,4-benzoxazin-3-one

Systemtic Name: 6-[[5-bromanyl-3-(2-phenylpyrazol-3-yl)-1-benzofuran-2-yl]carbonyl]-4-methyl-1,4-benzoxazin-3-one Openeye Name: 6-[5-bromo-3-(2-phenylpyrazol-3-yl)benzofuran-2-carbonyl]-4-methyl-1,4-benzoxazin-3-one CAS Name: 6-[[5-bromo-3-(2-phenyl-3-pyrazolyl)-2-benzofuranyl]-oxomethyl]-4-methyl-1,4-benzoxazin-3-one IUPAC Name: 6-[5-bromo-3-(2-phenylpyrazol-3-yl)-1-benzofuran-2-carbonyl]-4-methyl-1,4-benzoxazin-3-one Traditional Name: 6-[5-bromo-3-(2-phenylpyrazol-3-yl)benzofuran-2-carbonyl]-4-methyl-1,4-benzoxazin-3-one Formula: C27H18BrN3O4 MolecularWeight: 528.35352

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=C1C=C(C=C2)C(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C5=CC=NN5C6=CC=CC=C6

Isomeric SMILES

CN1C(=O)COC2=C1C=C(C=C2)C(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C5=CC=NN5C6=CC=CC=C6

InChI

InChI=1S/C27H18BrN3O4/c1-30-21-13-16(7-9-23(21)34-15-24(30)32)26(33)27-25(19-14-17(28)8-10-22(19)35-27)20-11-12-29-31(20)18-5-3-2-4-6-18/h2-14H,15H2,1H3