2-[3-[[(5-ethyl-6-oxidanylidene-5-phenylmethoxy-2H-pyran-3-yl)carbonylamino]methyl]quinolin-2-yl]propanoic acid

Systemtic Name: 2-[3-[[(5-ethyl-6-oxidanylidene-5-phenylmethoxy-2H-pyran-3-yl)carbonylamino]methyl]quinolin-2-yl]propanoic acid Openeye Name: 2-[3-[[(5-benzyloxy-5-ethyl-6-oxo-2H-pyran-3-carbonyl)amino]methyl]-2-quinolyl]propanoic acid CAS Name: 2-[3-[[[(5-ethyl-6-oxo-5-phenylmethoxy-2H-pyran-3-yl)-oxomethyl]amino]methyl]-2-quinolinyl]propanoic acid IUPAC Name: 2-[3-[[(5-ethyl-6-oxo-5-phenylmethoxy-2H-pyran-3-carbonyl)amino]methyl]quinolin-2-yl]propanoic acid Traditional Name: 2-[3-[[(5-benzoxy-5-ethyl-6-keto-2H-pyran-3-carbonyl)amino]methyl]-2-quinolyl]propionic acid Formula: C28H28N2O6 MolecularWeight: 488.53172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C(COC1=O)C(=O)NCC2=CC3=CC=CC=C3N=C2C(C)C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CCC1(C=C(COC1=O)C(=O)NCC2=CC3=CC=CC=C3N=C2C(C)C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O6/c1-3-28(36-16-19-9-5-4-6-10-19)14-22(17-35-27(28)34)25(31)29-15-21-13-20-11-7-8-12-23(20)30-24(21)18(2)26(32)33/h4-14,18H,3,15-17H2,1-2H3,(H,29,31)(H,32,33)