[2-oxidanylidene-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] 3-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] 3-bromanylbenzoate Openeye Name: [2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-keto-2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)ethyl] ester Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CC=C1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18BrNO3/c21-18-8-4-7-17(13-18)20(24)25-14-19(23)22-11-9-16(10-12-22)15-5-2-1-3-6-15/h1-9,13H,10-12,14H2