3-[5-[6-[(4-ethoxyphenyl)carbamoyl-ethyl-amino]pyridin-2-yl]furan-2-yl]propanoic acid

Systemtic Name: 3-[5-[6-[(4-ethoxyphenyl)carbamoyl-ethyl-amino]pyridin-2-yl]furan-2-yl]propanoic acid Openeye Name: 3-[5-[6-[(4-ethoxyphenyl)carbamoyl-ethyl-amino]-2-pyridyl]-2-furyl]propanoic acid CAS Name: 3-[5-[6-[[(4-ethoxyanilino)-oxomethyl]-ethylamino]-2-pyridinyl]-2-furanyl]propanoic acid IUPAC Name: 3-[5-[6-[(4-ethoxyphenyl)carbamoyl-ethylamino]pyridin-2-yl]furan-2-yl]propanoic acid Traditional Name: 3-[5-[6-[ethyl(p-phenetylcarbamoyl)amino]-2-pyridyl]-2-furyl]propionic acid Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=N1)C2=CC=C(O2)CCC(=O)O)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCN(C1=CC=CC(=N1)C2=CC=C(O2)CCC(=O)O)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C23H25N3O5/c1-3-26(23(29)24-16-8-10-17(11-9-16)30-4-2)21-7-5-6-19(25-21)20-14-12-18(31-20)13-15-22(27)28/h5-12,14H,3-4,13,15H2,1-2H3,(H,24,29)(H,27,28)