(E)-3-(3-bromanyl-4-methyl-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-(3-bromanyl-4-methyl-phenyl)-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-(3-bromo-4-methyl-phenyl)prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-(3-bromo-4-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-(3-bromo-4-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-(3-bromo-4-methyl-phenyl)acrylonitrile Formula: C17H12BrNO MolecularWeight: 326.18728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12BrNO/c1-12-7-8-13(10-16(12)18)9-15(11-19)17(20)14-5-3-2-4-6-14/h2-10H,1H3/b15-9+