(phenylmethyl) 3-phenyl-2-(3-pyridin-2-ylpropylcarbamoylamino)propanoate

Systemtic Name: (phenylmethyl) 3-phenyl-2-(3-pyridin-2-ylpropylcarbamoylamino)propanoate Openeye Name: benzyl 3-phenyl-2-[3-(2-pyridyl)propylcarbamoylamino]propanoate CAS Name: 2-[[oxo-[3-(2-pyridinyl)propylamino]methyl]amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-phenyl-2-(3-pyridin-2-ylpropylcarbamoylamino)propanoate Traditional Name: 3-phenyl-2-[3-(2-pyridyl)propylcarbamoylamino]propionic acid benzyl ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)NC(=O)NCCCC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)NC(=O)NCCCC3=CC=CC=N3

InChI

InChI=1S/C25H27N3O3/c29-24(31-19-21-12-5-2-6-13-21)23(18-20-10-3-1-4-11-20)28-25(30)27-17-9-15-22-14-7-8-16-26-22/h1-8,10-14,16,23H,9,15,17-19H2,(H2,27,28,30)