2-chloranyl-N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-(1-methyl-3-oxidanylidene-2-phenyl-5-propan-2-yl-pyrazol-4-yl)-4-nitro-benzamide Openeye Name: 2-chloro-N-(5-isopropyl-1-methyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-nitro-benzamide CAS Name: 2-chloro-N-(1-methyl-3-oxo-2-phenyl-5-propan-2-yl-4-pyrazolyl)-4-nitrobenzamide IUPAC Name: 2-chloro-N-(1-methyl-3-oxo-2-phenyl-5-propan-2-ylpyrazol-4-yl)-4-nitrobenzamide Traditional Name: 2-chloro-N-(5-isopropyl-3-keto-1-methyl-2-phenyl-3-pyrazolin-4-yl)-4-nitro-benzamide Formula: C20H19ClN4O4 MolecularWeight: 414.84226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)C1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H19ClN4O4/c1-12(2)18-17(20(27)24(23(18)3)13-7-5-4-6-8-13)22-19(26)15-10-9-14(25(28)29)11-16(15)21/h4-12H,1-3H3,(H,22,26)