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

Systemtic Name: 2-chloranyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-3,5-dinitro-benzamide Openeye Name: 2-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-3,5-dinitro-benzamide CAS Name: 2-chloro-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-3,5-dinitrobenzamide IUPAC Name: 2-chloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-3,5-dinitrobenzamide Traditional Name: 2-chloro-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3,5-dinitro-benzamide Formula: C18H14ClN5O6 MolecularWeight: 431.78666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC(=C3Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN5O6/c1-10-16(18(26)22(21(10)2)11-6-4-3-5-7-11)20-17(25)13-8-12(23(27)28)9-14(15(13)19)24(29)30/h3-9H,1-2H3,(H,20,25)