2-[methyl-[3-[methyl(2-pyridin-2-ylethyl)amino]-3-oxidanylidene-propyl]carbamoyl]oxy-3-phenyl-propanoic acid

Systemtic Name: 2-[methyl-[3-[methyl(2-pyridin-2-ylethyl)amino]-3-oxidanylidene-propyl]carbamoyl]oxy-3-phenyl-propanoic acid Openeye Name: 2-[methyl-[3-[methyl-[2-(2-pyridyl)ethyl]amino]-3-oxo-propyl]carbamoyl]oxy-3-phenyl-propanoic acid CAS Name: 2-[[methyl-[3-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-oxopropyl]amino]-oxomethoxy]-3-phenylpropanoic acid IUPAC Name: 2-[methyl-[3-[methyl(2-pyridin-2-ylethyl)amino]-3-oxopropyl]carbamoyl]oxy-3-phenylpropanoic acid Traditional Name: 2-[[3-keto-3-[methyl-[2-(2-pyridyl)ethyl]amino]propyl]-methyl-carbamoyl]oxy-3-phenyl-propionic acid Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C(=O)CCN(C)C(=O)OC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN(CCC1=CC=CC=N1)C(=O)CCN(C)C(=O)OC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H27N3O5/c1-24(14-11-18-10-6-7-13-23-18)20(26)12-15-25(2)22(29)30-19(21(27)28)16-17-8-4-3-5-9-17/h3-10,13,19H,11-12,14-16H2,1-2H3,(H,27,28)