[(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [(1R)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-piperidin-1-ylethyl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [(1R)-2-keto-1-phenyl-2-piperidino-ethyl] ester Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1CCN(CC1)C(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C20H20BrNO4/c21-15-9-10-17(23)16(13-15)20(25)26-18(14-7-3-1-4-8-14)19(24)22-11-5-2-6-12-22/h1,3-4,7-10,13,18,23H,2,5-6,11-12H2/t18-/m1/s1