5-fluoranyl-3-[(3-isocyanophenyl)carbonylamino]-4-oxidanylidene-pentanoic acid

Systemtic Name: 5-fluoranyl-3-[(3-isocyanophenyl)carbonylamino]-4-oxidanylidene-pentanoic acid Openeye Name: 5-fluoro-3-[(3-isocyanobenzoyl)amino]-4-oxo-pentanoic acid CAS Name: 5-fluoro-3-[[(3-isocyanophenyl)-oxomethyl]amino]-4-oxopentanoic acid IUPAC Name: 5-fluoro-3-[(3-isocyanobenzoyl)amino]-4-oxopentanoic acid Traditional Name: 5-fluoro-3-[(3-isocyanobenzoyl)amino]-4-keto-valeric acid Formula: C13H11FN2O4 MolecularWeight: 278.235843

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=CC(=C1)C(=O)NC(CC(=O)O)C(=O)CF

Isomeric SMILES

[C-]#[N+]C1=CC=CC(=C1)C(=O)NC(CC(=O)O)C(=O)CF

InChI

InChI=1S/C13H11FN2O4/c1-15-9-4-2-3-8(5-9)13(20)16-10(6-12(18)19)11(17)7-14/h2-5,10H,6-7H2,(H,16,20)(H,18,19)