4-chloranyl-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-3-nitro-benzamide Formula: C20H11ClN6O3 MolecularWeight: 418.79274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C#N)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H11ClN6O3/c21-15-7-5-13(9-17(15)27(29)30)20(28)25-19-14(10-22)11-23-26(19)18-8-6-12-3-1-2-4-16(12)24-18/h1-9,11H,(H,25,28)