(E)-3-(4-hexoxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-hexoxyphenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(4-hexoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(4-hexoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(4-hexoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(4-hexoxyphenyl)acrylonitrile Formula: C22H23NO2 MolecularWeight: 333.42352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H23NO2/c1-2-3-4-8-15-25-21-13-11-18(12-14-21)16-20(17-23)22(24)19-9-6-5-7-10-19/h5-7,9-14,16H,2-4,8,15H2,1H3/b20-16+