1-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[3,5-dimethyl-4-[(4-methyl-1-piperidyl)sulfonyl]pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[3,5-dimethyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-1-pyrazolyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[3,5-dimethyl-4-(4-methylpiperidin-1-yl)sulfonylpyrazol-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[3,5-dimethyl-4-(4-methylpiperidino)sulfonyl-pyrazol-1-yl]-2-(2-nitrophenoxy)ethanone Formula: C19H24N4O6S MolecularWeight: 436.48206

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C(=O)COC3=CC=CC=C3[N+](=O)[O-])C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(N(N=C2C)C(=O)COC3=CC=CC=C3[N+](=O)[O-])C

InChI

InChI=1S/C19H24N4O6S/c1-13-8-10-21(11-9-13)30(27,28)19-14(2)20-22(15(19)3)18(24)12-29-17-7-5-4-6-16(17)23(25)26/h4-7,13H,8-12H2,1-3H3