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

Systemtic Name: (E)-3-(4-bromanyl-3-nitro-phenyl)-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-3-(4-bromo-3-nitro-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(4-bromo-3-nitrophenyl)-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-3-(4-bromo-3-nitrophenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-benzyl-3-(4-bromo-3-nitro-phenyl)-2-cyano-acrylamide Formula: C17H12BrN3O3 MolecularWeight: 386.19948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=CC(=C(C=C2)Br)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)/C(=C/C2=CC(=C(C=C2)Br)[N+](=O)[O-])/C#N

InChI

InChI=1S/C17H12BrN3O3/c18-15-7-6-13(9-16(15)21(23)24)8-14(10-19)17(22)20-11-12-4-2-1-3-5-12/h1-9H,11H2,(H,20,22)/b14-8+