4-(4-bromophenyl)-N-(3-ethynylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(4-bromophenyl)-N-(3-ethynylphenyl)-4-oxidanylidene-butanamide Openeye Name: 4-(4-bromophenyl)-N-(3-ethynylphenyl)-4-oxo-butanamide CAS Name: 4-(4-bromophenyl)-N-(3-ethynylphenyl)-4-oxobutanamide IUPAC Name: 4-(4-bromophenyl)-N-(3-ethynylphenyl)-4-oxobutanamide Traditional Name: 4-(4-bromophenyl)-N-(3-ethynylphenyl)-4-keto-butyramide Formula: C18H14BrNO2 MolecularWeight: 356.21326

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H14BrNO2/c1-2-13-4-3-5-16(12-13)20-18(22)11-10-17(21)14-6-8-15(19)9-7-14/h1,3-9,12H,10-11H2,(H,20,22)