(E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-(4-bromo-3-nitro-phenyl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-(4-bromo-3-nitrophenyl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-(4-bromo-3-nitrophenyl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-(4-bromo-3-nitro-phenyl)-2-cyano-N-isopropyl-acrylamide Formula: C13H12BrN3O3 MolecularWeight: 338.15668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(C=C1)Br)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(C=C1)Br)[N+](=O)[O-])/C#N

InChI

InChI=1S/C13H12BrN3O3/c1-8(2)16-13(18)10(7-15)5-9-3-4-11(14)12(6-9)17(19)20/h3-6,8H,1-2H3,(H,16,18)/b10-5+