2-[6-butyl-2-oxidanylidene-3-(3-phenylpropanoylamino)pyridin-1-yl]ethanoic acid

Systemtic Name: 2-[6-butyl-2-oxidanylidene-3-(3-phenylpropanoylamino)pyridin-1-yl]ethanoic acid Openeye Name: 2-[6-butyl-2-oxo-3-(3-phenylpropanoylamino)-1-pyridyl]acetic acid CAS Name: 2-[6-butyl-2-oxo-3-[(1-oxo-3-phenylpropyl)amino]-1-pyridinyl]acetic acid IUPAC Name: 2-[6-butyl-2-oxo-3-(3-phenylpropanoylamino)pyridin-1-yl]acetic acid Traditional Name: 2-[6-butyl-3-(hydrocinnamoylamino)-2-keto-1-pyridyl]acetic acid Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1CC(=O)O)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC(=O)O)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O4/c1-2-3-9-16-11-12-17(20(26)22(16)14-19(24)25)21-18(23)13-10-15-7-5-4-6-8-15/h4-8,11-12H,2-3,9-10,13-14H2,1H3,(H,21,23)(H,24,25)