(E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-prop-2-ynoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-prop-2-ynoxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-prop-2-ynoxyphenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-propargyloxy-phenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide Formula: C20H15BrN2O3 MolecularWeight: 411.2487

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C(=CC2=C(C=CC(=C2)Br)OCC#C)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC#C)/C#N

InChI

InChI=1S/C20H15BrN2O3/c1-3-10-26-19-9-4-16(21)12-14(19)11-15(13-22)20(24)23-17-5-7-18(25-2)8-6-17/h1,4-9,11-12H,10H2,2H3,(H,23,24)/b15-11+