3-(2,5-dimethoxyphenyl)-1-[2-(5-nitrofuran-2-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,5-dimethoxyphenyl)-1-[2-(5-nitrofuran-2-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 3-(2,5-dimethoxyphenyl)-1-[2-(5-nitrofuran-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 3-(2,5-dimethoxyphenyl)-1-[2-[(5-nitro-2-furanyl)-oxomethyl]-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 3-(2,5-dimethoxyphenyl)-1-[2-(5-nitrofuran-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 3-(2,5-dimethoxyphenyl)-1-[2-(5-nitro-2-furoyl)pyrazolidin-1-yl]prop-2-en-1-one Formula: C19H19N3O7 MolecularWeight: 401.37006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O7/c1-27-14-5-6-15(28-2)13(12-14)4-8-17(23)20-10-3-11-21(20)19(24)16-7-9-18(29-16)22(25)26/h4-9,12H,3,10-11H2,1-2H3