(2-oxidanylidene-1,2-diphenyl-ethyl) 1-pyrimidin-2-ylpiperidine-4-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 1-pyrimidin-2-ylpiperidine-4-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 1-pyrimidin-2-ylpiperidine-4-carboxylate CAS Name: 1-(2-pyrimidinyl)-4-piperidinecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 1-pyrimidin-2-ylpiperidine-4-carboxylate Traditional Name: 1-(2-pyrimidyl)isonipecotic acid desyl ester Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C24H23N3O3/c28-21(18-8-3-1-4-9-18)22(19-10-5-2-6-11-19)30-23(29)20-12-16-27(17-13-20)24-25-14-7-15-26-24/h1-11,14-15,20,22H,12-13,16-17H2