2-chloranyl-N-[2-fluoranyl-5-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-fluoranyl-5-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-fluoro-5-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[2-fluoro-5-(2-methyl-4-oxo-3-quinazolinyl)phenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[2-fluoro-5-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[2-fluoro-5-(4-keto-2-methyl-quinazolin-3-yl)phenyl]-5-nitro-benzamide Formula: C22H14ClFN4O4 MolecularWeight: 452.822363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)F)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H14ClFN4O4/c1-12-25-19-5-3-2-4-15(19)22(30)27(12)13-7-9-18(24)20(11-13)26-21(29)16-10-14(28(31)32)6-8-17(16)23/h2-11H,1H3,(H,26,29)