2-(4-methylsulfonylphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one

Systemtic Name: 2-(4-methylsulfonylphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Openeye Name: 2-(4-methylsulfonylphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one CAS Name: 2-(4-methylsulfonylphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one IUPAC Name: 2-(4-methylsulfonylphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Traditional Name: 2-(4-mesylphenyl)-4,5,6,7-tetrahydro-3aH-indazol-3-one Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=O)C3CCCCC3=N2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=O)C3CCCCC3=N2

InChI

InChI=1S/C14H16N2O3S/c1-20(18,19)11-8-6-10(7-9-11)16-14(17)12-4-2-3-5-13(12)15-16/h6-9,12H,2-5H2,1H3