(E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]-2-cyano-N-(2-methylcyclohexyl)prop-2-enamide

Systemtic Name: (E)-3-[5-(4-chloranyl-2-nitro-phenyl)furan-2-yl]-2-cyano-N-(2-methylcyclohexyl)prop-2-enamide Openeye Name: (E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]-2-cyano-N-(2-methylcyclohexyl)prop-2-enamide CAS Name: (E)-3-[5-(4-chloro-2-nitrophenyl)-2-furanyl]-2-cyano-N-(2-methylcyclohexyl)-2-propenamide IUPAC Name: (E)-3-[5-(4-chloro-2-nitrophenyl)furan-2-yl]-2-cyano-N-(2-methylcyclohexyl)prop-2-enamide Traditional Name: (E)-3-[5-(4-chloro-2-nitro-phenyl)-2-furyl]-2-cyano-N-(2-methylcyclohexyl)acrylamide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

CC1CCCCC1NC(=O)/C(=C/C2=CC=C(O2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-])/C#N

InChI

InChI=1S/C21H20ClN3O4/c1-13-4-2-3-5-18(13)24-21(26)14(12-23)10-16-7-9-20(29-16)17-8-6-15(22)11-19(17)25(27)28/h6-11,13,18H,2-5H2,1H3,(H,24,26)/b14-10+