2-[4-[(Z)-3-(4-fluorophenyl)-3-oxidanyl-prop-2-enoyl]-3-oxidanyl-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(Z)-3-(4-fluorophenyl)-3-oxidanyl-prop-2-enoyl]-3-oxidanyl-phenoxy]ethanenitrile Openeye Name: 2-[4-[(Z)-3-(4-fluorophenyl)-3-hydroxy-prop-2-enoyl]-3-hydroxy-phenoxy]acetonitrile CAS Name: 2-[4-[(Z)-3-(4-fluorophenyl)-3-hydroxy-1-oxoprop-2-enyl]-3-hydroxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(Z)-3-(4-fluorophenyl)-3-hydroxyprop-2-enoyl]-3-hydroxyphenoxy]acetonitrile Traditional Name: 2-[4-[(Z)-3-(4-fluorophenyl)-3-hydroxy-acryloyl]-3-hydroxy-phenoxy]acetonitrile Formula: C17H12FNO4 MolecularWeight: 313.279883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=CC(=O)C2=C(C=C(C=C2)OCC#N)O)O)F

Isomeric SMILES

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

InChI

InChI=1S/C17H12FNO4/c18-12-3-1-11(2-4-12)15(20)10-17(22)14-6-5-13(9-16(14)21)23-8-7-19/h1-6,9-10,20-21H,8H2/b15-10-