(E)-3-(3-chloranyl-5-methyl-4-oxidanyl-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-chloranyl-5-methyl-4-oxidanyl-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3-chloro-4-hydroxy-5-methyl-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3-chloro-4-hydroxy-5-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3-chloro-4-hydroxy-5-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3-chloro-4-hydroxy-5-methyl-phenyl)acrylonitrile Formula: C17H12ClNO2 MolecularWeight: 297.73568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C=C(C#N)C(=O)C2=CC=CC=C2)Cl)O

Isomeric SMILES

CC1=C(C(=CC(=C1)/C=C(\C#N)/C(=O)C2=CC=CC=C2)Cl)O

InChI

InChI=1S/C17H12ClNO2/c1-11-7-12(9-15(18)16(11)20)8-14(10-19)17(21)13-5-3-2-4-6-13/h2-9,20H,1H3/b14-8+