3-[4-(3-bromophenyl)-1-ethyl-7-methyl-2-oxidanylidene-1,8-naphthyridin-3-yl]propanoic acid

Systemtic Name: 3-[4-(3-bromophenyl)-1-ethyl-7-methyl-2-oxidanylidene-1,8-naphthyridin-3-yl]propanoic acid Openeye Name: 3-[4-(3-bromophenyl)-1-ethyl-7-methyl-2-oxo-1,8-naphthyridin-3-yl]propanoic acid CAS Name: 3-[4-(3-bromophenyl)-1-ethyl-7-methyl-2-oxo-1,8-naphthyridin-3-yl]propanoic acid IUPAC Name: 3-[4-(3-bromophenyl)-1-ethyl-7-methyl-2-oxo-1,8-naphthyridin-3-yl]propanoic acid Traditional Name: 3-[4-(3-bromophenyl)-1-ethyl-2-keto-7-methyl-1,8-naphthyridin-3-yl]propionic acid Formula: C20H19BrN2O3 MolecularWeight: 415.28046

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=N2)C)C(=C(C1=O)CCC(=O)O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCN1C2=C(C=CC(=N2)C)C(=C(C1=O)CCC(=O)O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H19BrN2O3/c1-3-23-19-15(8-7-12(2)22-19)18(13-5-4-6-14(21)11-13)16(20(23)26)9-10-17(24)25/h4-8,11H,3,9-10H2,1-2H3,(H,24,25)