3-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-2-pyrrolidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-(3,5-dibromo-2-hydroxy-phenyl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile CAS Name: 3-(3,5-dibromo-2-hydroxyphenyl)-2-[oxo(1-pyrrolidinyl)methyl]-2-propenenitrile IUPAC Name: 3-(3,5-dibromo-2-hydroxyphenyl)-2-(pyrrolidine-1-carbonyl)prop-2-enenitrile Traditional Name: 3-(3,5-dibromo-2-hydroxy-phenyl)-2-(pyrrolidine-1-carbonyl)acrylonitrile Formula: C14H12Br2N2O2 MolecularWeight: 400.06528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=CC(=CC(=C2O)Br)Br)C#N

Isomeric SMILES

C1CCN(C1)C(=O)C(=CC2=CC(=CC(=C2O)Br)Br)C#N

InChI

InChI=1S/C14H12Br2N2O2/c15-11-6-9(13(19)12(16)7-11)5-10(8-17)14(20)18-3-1-2-4-18/h5-7,19H,1-4H2