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

Systemtic Name: (E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-prop-2-ynoxy-phenyl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-(5-bromo-2-propargyloxy-phenyl)-2-cyano-N-isopropyl-acrylamide Formula: C16H15BrN2O2 MolecularWeight: 347.2065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=C(C=CC(=C1)Br)OCC#C)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=C(C=CC(=C1)Br)OCC#C)/C#N

InChI

InChI=1S/C16H15BrN2O2/c1-4-7-21-15-6-5-14(17)9-12(15)8-13(10-18)16(20)19-11(2)3/h1,5-6,8-9,11H,7H2,2-3H3,(H,19,20)/b13-8+