3-(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-8-methylsulfonyl-3,4-dihydroindeno[1,2-c][1,2]oxazole-3a-carbaldehyde

Systemtic Name: 3-(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-8-methylsulfonyl-3,4-dihydroindeno[1,2-c][1,2]oxazole-3a-carbaldehyde Openeye Name: 3-(2-methyl-3-oxo-1H-pyrazol-4-yl)-8-methylsulfonyl-3,4-dihydroindeno[1,2-c]isoxazole-3a-carbaldehyde CAS Name: 3-(2-methyl-3-oxo-1H-pyrazol-4-yl)-8-methylsulfonyl-3,4-dihydroindeno[1,2-c]isoxazole-3a-carboxaldehyde IUPAC Name: 3-(2-methyl-3-oxo-1H-pyrazol-4-yl)-8-methylsulfonyl-3,4-dihydroindeno[1,2-c][1,2]oxazole-3a-carbaldehyde Traditional Name: 3-(5-keto-1-methyl-3-pyrazolin-4-yl)-8-mesyl-3,4-dihydroinden[1,2-c]isoxazole-3a-carbaldehyde Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN1)C2C3(CC4=C(C3=NO2)C(=CC=C4)S(=O)(=O)C)C=O

Isomeric SMILES

CN1C(=O)C(=CN1)C2C3(CC4=C(C3=NO2)C(=CC=C4)S(=O)(=O)C)C=O

InChI

InChI=1S/C16H15N3O5S/c1-19-15(21)10(7-17-19)14-16(8-20)6-9-4-3-5-11(25(2,22)23)12(9)13(16)18-24-14/h3-5,7-8,14,17H,6H2,1-2H3