2-[[6-(6-chloranylpyrimidin-4-yl)-1-methyl-2-oxidanyl-4-oxidanylidene-1,8-naphthyridin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[6-(6-chloranylpyrimidin-4-yl)-1-methyl-2-oxidanyl-4-oxidanylidene-1,8-naphthyridin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[6-(6-chloropyrimidin-4-yl)-2-hydroxy-1-methyl-4-oxo-1,8-naphthyridine-3-carbonyl]amino]acetic acid CAS Name: 2-[[[6-(6-chloro-4-pyrimidinyl)-2-hydroxy-1-methyl-4-oxo-1,8-naphthyridin-3-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[6-(6-chloropyrimidin-4-yl)-2-hydroxy-1-methyl-4-oxo-1,8-naphthyridine-3-carbonyl]amino]acetic acid Traditional Name: 2-[[6-(6-chloropyrimidin-4-yl)-2-hydroxy-4-keto-1-methyl-1,8-naphthyridine-3-carbonyl]amino]acetic acid Formula: C16H12ClN5O5 MolecularWeight: 389.74998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)C2=CC(=CN=C21)C3=CC(=NC=N3)Cl)C(=O)NCC(=O)O)O

Isomeric SMILES

CN1C(=C(C(=O)C2=CC(=CN=C21)C3=CC(=NC=N3)Cl)C(=O)NCC(=O)O)O

InChI

InChI=1S/C16H12ClN5O5/c1-22-14-8(2-7(4-18-14)9-3-10(17)21-6-20-9)13(25)12(16(22)27)15(26)19-5-11(23)24/h2-4,6,27H,5H2,1H3,(H,19,26)(H,23,24)