[1-methyl-5-[(3S)-3-methylpiperidin-1-yl]sulfonylimino-pyrazol-4-ylidene]methanediolate

Systemtic Name: [1-methyl-5-[(3S)-3-methylpiperidin-1-yl]sulfonylimino-pyrazol-4-ylidene]methanediolate Openeye Name: [1-methyl-5-[[(3S)-3-methyl-1-piperidyl]sulfonylimino]pyrazol-4-ylidene]methanediolate CAS Name: [1-methyl-5-[[(3S)-3-methyl-1-piperidinyl]sulfonylimino]-4-pyrazolylidene]methanediolate IUPAC Name: [1-methyl-5-[(3S)-3-methylpiperidin-1-yl]sulfonyliminopyrazol-4-ylidene]methanediolate Traditional Name: [1-methyl-5-[(3S)-3-methylpiperidino]sulfonylimino-2-pyrazolin-4-ylidene]methanediolate Formula: C11H16N4O4S-2 MolecularWeight: 300.33414

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)N=C2C(=C([O-])[O-])C=NN2C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)N=C2C(=C([O-])[O-])C=NN2C

InChI

InChI=1S/C11H18N4O4S/c1-8-4-3-5-15(7-8)20(18,19)13-10-9(11(16)17)6-12-14(10)2/h6,8,16-17H,3-5,7H2,1-2H3/p-2/t8-/m0/s1