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

Systemtic Name: 2-[[6-(4,6-dimethylpyrimidin-2-yl)-1-methyl-2-oxidanyl-4-oxidanylidene-1,8-naphthyridin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[6-(4,6-dimethylpyrimidin-2-yl)-2-hydroxy-1-methyl-4-oxo-1,8-naphthyridine-3-carbonyl]amino]acetic acid CAS Name: 2-[[[6-(4,6-dimethyl-2-pyrimidinyl)-2-hydroxy-1-methyl-4-oxo-1,8-naphthyridin-3-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[6-(4,6-dimethylpyrimidin-2-yl)-2-hydroxy-1-methyl-4-oxo-1,8-naphthyridine-3-carbonyl]amino]acetic acid Traditional Name: 2-[[6-(4,6-dimethylpyrimidin-2-yl)-2-hydroxy-4-keto-1-methyl-1,8-naphthyridine-3-carbonyl]amino]acetic acid Formula: C18H17N5O5 MolecularWeight: 383.35808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CN=C3C(=C2)C(=O)C(=C(N3C)O)C(=O)NCC(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CN=C3C(=C2)C(=O)C(=C(N3C)O)C(=O)NCC(=O)O)C

InChI

InChI=1S/C18H17N5O5/c1-8-4-9(2)22-15(21-8)10-5-11-14(26)13(17(27)20-7-12(24)25)18(28)23(3)16(11)19-6-10/h4-6,28H,7H2,1-3H3,(H,20,27)(H,24,25)