4-[[2-(2-chloranyl-6-fluoranyl-phenyl)-2-(dimethylamino)ethyl]amino]-N-cyclopropyl-3-nitro-benzamide

Systemtic Name: 4-[[2-(2-chloranyl-6-fluoranyl-phenyl)-2-(dimethylamino)ethyl]amino]-N-cyclopropyl-3-nitro-benzamide Openeye Name: 4-[[2-(2-chloro-6-fluoro-phenyl)-2-(dimethylamino)ethyl]amino]-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-[[2-(2-chloro-6-fluorophenyl)-2-(dimethylamino)ethyl]amino]-N-cyclopropyl-3-nitrobenzamide IUPAC Name: 4-[[2-(2-chloro-6-fluorophenyl)-2-(dimethylamino)ethyl]amino]-N-cyclopropyl-3-nitrobenzamide Traditional Name: 4-[[2-(2-chloro-6-fluoro-phenyl)-2-(dimethylamino)ethyl]amino]-N-cyclopropyl-3-nitro-benzamide Formula: C20H22ClFN4O3 MolecularWeight: 420.865083

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=C(C=C(C=C1)C(=O)NC2CC2)[N+](=O)[O-])C3=C(C=CC=C3Cl)F

Isomeric SMILES

CN(C)C(CNC1=C(C=C(C=C1)C(=O)NC2CC2)[N+](=O)[O-])C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H22ClFN4O3/c1-25(2)18(19-14(21)4-3-5-15(19)22)11-23-16-9-6-12(10-17(16)26(28)29)20(27)24-13-7-8-13/h3-6,9-10,13,18,23H,7-8,11H2,1-2H3,(H,24,27)