(phenylmethyl) 2-[methyl-[2-oxidanylidene-2-(pyridin-4-ylmethylamino)ethyl]carbamoyl]oxy-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-[methyl-[2-oxidanylidene-2-(pyridin-4-ylmethylamino)ethyl]carbamoyl]oxy-3-phenyl-propanoate Openeye Name: benzyl 2-[methyl-[2-oxo-2-(4-pyridylmethylamino)ethyl]carbamoyl]oxy-3-phenyl-propanoate CAS Name: 2-[[methyl-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]amino]-oxomethoxy]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[methyl-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]carbamoyl]oxy-3-phenylpropanoate Traditional Name: 2-[[2-keto-2-(4-pyridylmethylamino)ethyl]-methyl-carbamoyl]oxy-3-phenyl-propionic acid benzyl ester Formula: C26H27N3O5 MolecularWeight: 461.50968

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1=CC=NC=C1)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)NCC1=CC=NC=C1)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O5/c1-29(18-24(30)28-17-21-12-14-27-15-13-21)26(32)34-23(16-20-8-4-2-5-9-20)25(31)33-19-22-10-6-3-7-11-22/h2-15,23H,16-19H2,1H3,(H,28,30)