(phenylmethyl) 2-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]-3-phenyl-propanoate Openeye Name: benzyl 2-[[methyl-[2-(2-pyridyl)ethyl]carbamoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[methyl-[2-(2-pyridinyl)ethyl]amino]-oxomethyl]amino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[methyl(2-pyridin-2-ylethyl)carbamoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[methyl-[2-(2-pyridyl)ethyl]carbamoyl]amino]-3-phenyl-propionic acid benzyl ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC=CC=N1)C(=O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3/c1-28(17-15-22-14-8-9-16-26-22)25(30)27-23(18-20-10-4-2-5-11-20)24(29)31-19-21-12-6-3-7-13-21/h2-14,16,23H,15,17-19H2,1H3,(H,27,30)