N-(2-cyanoethyl)-N-(2-fluorophenyl)-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-4-morpholino-3-nitro-benzamide CAS Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(2-cyanoethyl)-N-(2-fluorophenyl)-4-morpholino-3-nitro-benzamide Formula: C20H19FN4O4 MolecularWeight: 398.387663

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)N(CCC#N)C3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)N(CCC#N)C3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C20H19FN4O4/c21-16-4-1-2-5-17(16)24(9-3-8-22)20(26)15-6-7-18(19(14-15)25(27)28)23-10-12-29-13-11-23/h1-2,4-7,14H,3,9-13H2