(4-methoxy-5-nitro-thiophen-3-yl)-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]methanone

Systemtic Name: (4-methoxy-5-nitro-thiophen-3-yl)-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]methanone Openeye Name: (4-methoxy-5-nitro-3-thienyl)-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]methanone CAS Name: (4-methoxy-5-nitro-3-thiophenyl)-[2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinyl]methanone IUPAC Name: (4-methoxy-5-nitrothiophen-3-yl)-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]methanone Traditional Name: (4-methoxy-5-nitro-3-thienyl)-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]methanone Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC=C1C(=O)N2CCCN2C(=O)C3(CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(SC=C1C(=O)N2CCCN2C(=O)C3(CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O5S/c1-27-15-14(12-28-17(15)22(25)26)16(23)20-10-5-11-21(20)18(24)19(8-9-19)13-6-3-2-4-7-13/h2-4,6-7,12H,5,8-11H2,1H3