2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)butanamide

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)butanamide Openeye Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)butanamide CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-(4-methyl-3,5-dinitrophenyl)butanamide IUPAC Name: 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(4-methyl-3,5-dinitrophenyl)butanamide Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(4-methyl-3,5-dinitro-phenyl)butyramide Formula: C16H18ClN5O5 MolecularWeight: 395.79762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])C)[N+](=O)[O-])N2C(=C(C(=N2)C)Cl)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])C)[N+](=O)[O-])N2C(=C(C(=N2)C)Cl)C

InChI

InChI=1S/C16H18ClN5O5/c1-5-12(20-10(4)15(17)9(3)19-20)16(23)18-11-6-13(21(24)25)8(2)14(7-11)22(26)27/h6-7,12H,5H2,1-4H3,(H,18,23)