[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] (2R)-2-benzamido-3-phenyl-propanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] (2R)-2-benzamido-3-phenyl-propanoate Openeye Name: [2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl] (2R)-2-benzamido-3-phenyl-propanoate CAS Name: (2R)-2-benzamido-3-phenylpropanoic acid [2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl] (2R)-2-benzamido-3-phenylpropanoate Traditional Name: (2R)-2-benzamido-3-phenyl-propionic acid [2-keto-2-[4-(2-pyridyl)piperazino]ethyl] ester Formula: C27H28N4O4 MolecularWeight: 472.53562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)COC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)COC(=O)[C@@H](CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O4/c32-25(31-17-15-30(16-18-31)24-13-7-8-14-28-24)20-35-27(34)23(19-21-9-3-1-4-10-21)29-26(33)22-11-5-2-6-12-22/h1-14,23H,15-20H2,(H,29,33)/t23-/m1/s1