3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-[2-(5-nitrofuran-2-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1-[2-(5-nitrofuran-2-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-[2-(5-nitrofuran-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1-[2-[(5-nitro-2-furanyl)-oxomethyl]-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 3-(5-chloro-1,3-dimethylpyrazol-4-yl)-1-[2-(5-nitrofuran-2-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1-[2-(5-nitro-2-furoyl)pyrazolidin-1-yl]prop-2-en-1-one Formula: C16H16ClN5O5 MolecularWeight: 393.78174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=O)C3=CC=C(O3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)N2CCCN2C(=O)C3=CC=C(O3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C16H16ClN5O5/c1-10-11(15(17)19(2)18-10)4-6-13(23)20-8-3-9-21(20)16(24)12-5-7-14(27-12)22(25)26/h4-7H,3,8-9H2,1-2H3