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

Systemtic Name: (E)-N-(5-chloranyl-2-morpholin-4-yl-phenyl)-2-cyano-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enamide Openeye Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-morpholinyl)phenyl]-2-cyano-3-(3-nitro-4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-N-(5-chloro-2-morpholin-4-ylphenyl)-2-cyano-3-(3-nitro-4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-N-(5-chloro-2-morpholino-phenyl)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)acrylamide Formula: C23H23ClN4O4 MolecularWeight: 454.90612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C23H23ClN4O4/c1-15(2)19-5-3-16(12-22(19)28(30)31)11-17(14-25)23(29)26-20-13-18(24)4-6-21(20)27-7-9-32-10-8-27/h3-6,11-13,15H,7-10H2,1-2H3,(H,26,29)/b17-11+