(E)-3-(3-methoxy-4-prop-2-ynoxy-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-methoxy-4-prop-2-ynoxy-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3-methoxy-4-prop-2-ynoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3-methoxy-4-prop-2-ynoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3-methoxy-4-prop-2-ynoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3-methoxy-4-propargyloxy-phenyl)acrylonitrile Formula: C20H15NO3 MolecularWeight: 317.338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15NO3/c1-3-11-24-18-10-9-15(13-19(18)23-2)12-17(14-21)20(22)16-7-5-4-6-8-16/h1,4-10,12-13H,11H2,2H3/b17-12+