N-[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[3-[(3-chloranyl-4-fluoranyl-phenyl)carbamoyl]phenyl]-3,5-dinitro-benzamide Openeye Name: N-[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]phenyl]-3,5-dinitro-benzamide CAS Name: N-[3-[(3-chloro-4-fluoroanilino)-oxomethyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[3-[(3-chloro-4-fluorophenyl)carbamoyl]phenyl]-3,5-dinitrobenzamide Traditional Name: N-[3-[(3-chloro-4-fluoro-phenyl)carbamoyl]phenyl]-3,5-dinitro-benzamide Formula: C20H12ClFN4O6 MolecularWeight: 458.783883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H12ClFN4O6/c21-17-9-14(4-5-18(17)22)24-19(27)11-2-1-3-13(6-11)23-20(28)12-7-15(25(29)30)10-16(8-12)26(31)32/h1-10H,(H,23,28)(H,24,27)