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

Systemtic Name: 2-[methyl-[2-oxidanylidene-2-(pyridin-4-ylmethylamino)ethyl]carbamoyl]oxy-3-phenyl-propanoic acid Openeye Name: 2-[methyl-[2-oxo-2-(4-pyridylmethylamino)ethyl]carbamoyl]oxy-3-phenyl-propanoic acid CAS Name: 2-[[methyl-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]amino]-oxomethoxy]-3-phenylpropanoic acid IUPAC Name: 2-[methyl-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]carbamoyl]oxy-3-phenylpropanoic acid Traditional Name: 2-[[2-keto-2-(4-pyridylmethylamino)ethyl]-methyl-carbamoyl]oxy-3-phenyl-propionic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5/c1-22(13-17(23)21-12-15-7-9-20-10-8-15)19(26)27-16(18(24)25)11-14-5-3-2-4-6-14/h2-10,16H,11-13H2,1H3,(H,21,23)(H,24,25)