2-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(2-phenylazanylethanoylamino)ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(2-phenylazanylethanoylamino)ethanoic acid Openeye Name: 2-[(2-anilinoacetyl)amino]-2-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)acetic acid CAS Name: 2-[(2-anilino-1-oxoethyl)amino]-2-(5-fluoro-2,4-dioxo-1-pyrimidinyl)acetic acid IUPAC Name: 2-[(2-anilinoacetyl)amino]-2-(5-fluoro-2,4-dioxopyrimidin-1-yl)acetic acid Traditional Name: 2-[(2-anilinoacetyl)amino]-2-(5-fluoro-2,4-diketo-pyrimidin-1-yl)acetic acid Formula: C14H13FN4O5 MolecularWeight: 336.275223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC(=O)NC(C(=O)O)N2C=C(C(=O)NC2=O)F

Isomeric SMILES

C1=CC=C(C=C1)NCC(=O)NC(C(=O)O)N2C=C(C(=O)NC2=O)F

InChI

InChI=1S/C14H13FN4O5/c15-9-7-19(14(24)18-12(9)21)11(13(22)23)17-10(20)6-16-8-4-2-1-3-5-8/h1-5,7,11,16H,6H2,(H,17,20)(H,22,23)(H,18,21,24)