1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]-2-(2-nitrophenoxy)ethanone Formula: C19H19N3O7S MolecularWeight: 433.43506

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O7S/c1-30(27,28)17-10-5-2-7-14(17)19(24)21-12-6-11-20(21)18(23)13-29-16-9-4-3-8-15(16)22(25)26/h2-5,7-10H,6,11-13H2,1H3