(phenylmethyl) 4-[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]-1-(phenylmethyl)piperazine-2-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-(4-cyanophenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]-1-(phenylmethyl)piperazine-2-carboxylate Openeye Name: benzyl 1-benzyl-4-[3-(4-cyanophenyl)-2-oxo-oxazolidin-5-yl]piperazine-2-carboxylate CAS Name: 4-[3-(4-cyanophenyl)-2-oxo-5-oxazolidinyl]-1-(phenylmethyl)-2-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-benzyl-4-[3-(4-cyanophenyl)-2-oxo-1,3-oxazolidin-5-yl]piperazine-2-carboxylate Traditional Name: 1-benzyl-4-[3-(4-cyanophenyl)-2-keto-oxazolidin-5-yl]piperazine-2-carboxylic acid benzyl ester Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C2CN(C(=O)O2)C3=CC=C(C=C3)C#N)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C(CN1C2CN(C(=O)O2)C3=CC=C(C=C3)C#N)C(=O)OCC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O4/c30-17-22-11-13-25(14-12-22)33-20-27(37-29(33)35)32-16-15-31(18-23-7-3-1-4-8-23)26(19-32)28(34)36-21-24-9-5-2-6-10-24/h1-14,26-27H,15-16,18-21H2