4-[(E)-3-(4-chloranyl-2-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-(4-chloranyl-2-oxidanyl-phenyl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-(4-chloro-2-hydroxy-phenyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-(4-chloro-2-hydroxyphenyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-(4-chloro-2-hydroxyphenyl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-(4-chloro-2-hydroxy-phenyl)-3-keto-prop-1-enyl]benzonitrile Formula: C16H10ClNO2 MolecularWeight: 283.7091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2)Cl)O)C#N

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=C(C=C(C=C2)Cl)O)C#N

InChI

InChI=1S/C16H10ClNO2/c17-13-6-7-14(16(20)9-13)15(19)8-5-11-1-3-12(10-18)4-2-11/h1-9,20H/b8-5+