2-ethoxy-3-[4-[6-[methyl(pentylcarbamoyl)amino]pyridin-2-yl]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[6-[methyl(pentylcarbamoyl)amino]pyridin-2-yl]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[6-[methyl(pentylcarbamoyl)amino]-2-pyridyl]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[6-[methyl-[oxo-(pentylamino)methyl]amino]-2-pyridinyl]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[6-[methyl(pentylcarbamoyl)amino]pyridin-2-yl]phenyl]propanoic acid Traditional Name: 3-[4-[6-[amylcarbamoyl(methyl)amino]-2-pyridyl]phenyl]-2-ethoxy-propionic acid Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)N(C)C1=CC=CC(=N1)C2=CC=C(C=C2)CC(C(=O)O)OCC

Isomeric SMILES

CCCCCNC(=O)N(C)C1=CC=CC(=N1)C2=CC=C(C=C2)CC(C(=O)O)OCC

InChI

InChI=1S/C23H31N3O4/c1-4-6-7-15-24-23(29)26(3)21-10-8-9-19(25-21)18-13-11-17(12-14-18)16-20(22(27)28)30-5-2/h8-14,20H,4-7,15-16H2,1-3H3,(H,24,29)(H,27,28)