(E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-N-(2-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-N-(2-methylphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-prop-2-ynoxy-phenyl)-2-cyano-N-(o-tolyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-N-(2-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-N-(2-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-propargyloxy-phenyl)-2-cyano-N-(o-tolyl)acrylamide Formula: C20H15BrN2O2 MolecularWeight: 395.2493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CC2=C(C=CC(=C2)Br)OCC#C)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC#C)/C#N

InChI

InChI=1S/C20H15BrN2O2/c1-3-10-25-19-9-8-17(21)12-15(19)11-16(13-22)20(24)23-18-7-5-4-6-14(18)2/h1,4-9,11-12H,10H2,2H3,(H,23,24)/b16-11+