(phenylmethyl) 4-(3-bromanyl-2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-4-yl)oxypiperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(3-bromanyl-2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-4-yl)oxypiperidine-1-carboxylate Openeye Name: benzyl 4-[[3-bromo-2-oxo-1-phenyl-5-(2-pyridyl)-4-pyridyl]oxy]piperidine-1-carboxylate CAS Name: 4-[[3-bromo-2-oxo-1-phenyl-5-(2-pyridinyl)-4-pyridinyl]oxy]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-bromo-2-oxo-1-phenyl-5-pyridin-2-ylpyridin-4-yl)oxypiperidine-1-carboxylate Traditional Name: 4-[[3-bromo-2-keto-1-phenyl-5-(2-pyridyl)-4-pyridyl]oxy]piperidine-1-carboxylic acid benzyl ester Formula: C29H26BrN3O4 MolecularWeight: 560.43844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=C(C(=O)N(C=C2C3=CC=CC=N3)C4=CC=CC=C4)Br)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1OC2=C(C(=O)N(C=C2C3=CC=CC=N3)C4=CC=CC=C4)Br)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H26BrN3O4/c30-26-27(37-23-14-17-32(18-15-23)29(35)36-20-21-9-3-1-4-10-21)24(25-13-7-8-16-31-25)19-33(28(26)34)22-11-5-2-6-12-22/h1-13,16,19,23H,14-15,17-18,20H2