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

Systemtic Name: (phenylmethyl) 2-[methyl-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]carbamoyl]oxy-3-phenyl-propanoate Openeye Name: benzyl 2-[methyl-[3-oxo-3-(2-pyridylmethylamino)propyl]carbamoyl]oxy-3-phenyl-propanoate CAS Name: 2-[[methyl-[3-oxo-3-(2-pyridinylmethylamino)propyl]amino]-oxomethoxy]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[methyl-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]carbamoyl]oxy-3-phenylpropanoate Traditional Name: 2-[[3-keto-3-(2-pyridylmethylamino)propyl]-methyl-carbamoyl]oxy-3-phenyl-propionic acid benzyl ester Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NCC1=CC=CC=N1)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(CCC(=O)NCC1=CC=CC=N1)C(=O)OC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O5/c1-30(17-15-25(31)29-19-23-14-8-9-16-28-23)27(33)35-24(18-21-10-4-2-5-11-21)26(32)34-20-22-12-6-3-7-13-22/h2-14,16,24H,15,17-20H2,1H3,(H,29,31)