(phenylmethyl) (2R)-4-oxidanylidene-2-(phenylmethyl)-4-(2-pyridin-2-ylethylamino)butanoate

Systemtic Name: (phenylmethyl) (2R)-4-oxidanylidene-2-(phenylmethyl)-4-(2-pyridin-2-ylethylamino)butanoate Openeye Name: benzyl (2R)-2-benzyl-4-oxo-4-[2-(2-pyridyl)ethylamino]butanoate CAS Name: (2R)-4-oxo-2-(phenylmethyl)-4-[2-(2-pyridinyl)ethylamino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-benzyl-4-oxo-4-(2-pyridin-2-ylethylamino)butanoate Traditional Name: (2R)-2-benzyl-4-keto-4-[2-(2-pyridyl)ethylamino]butyric acid benzyl ester Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)NCCC2=CC=CC=N2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](CC(=O)NCCC2=CC=CC=N2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O3/c28-24(27-16-14-23-13-7-8-15-26-23)18-22(17-20-9-3-1-4-10-20)25(29)30-19-21-11-5-2-6-12-21/h1-13,15,22H,14,16-19H2,(H,27,28)/t22-/m1/s1