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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2)Br)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)Br)[N+](=O)[O-])/C#N

InChI

InChI=1S/C17H12BrN3O3/c1-11-3-2-4-14(7-11)20-17(22)13(10-19)8-12-5-6-15(18)16(9-12)21(23)24/h2-9H,1H3,(H,20,22)/b13-8+