(E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(4-hydroxy-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(4-hydroxy-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)acrylamide Formula: C20H17ClN4O5 MolecularWeight: 428.82578

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)C(=CC3=CC(=C(C=C3)O)[N+](=O)[O-])C#N

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Cl)NC(=O)/C(=C/C3=CC(=C(C=C3)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C20H17ClN4O5/c21-15-2-3-17(24-5-7-30-8-6-24)16(11-15)23-20(27)14(12-22)9-13-1-4-19(26)18(10-13)25(28)29/h1-4,9-11,26H,5-8H2,(H,23,27)/b14-9+