methyl 4-fluoranyl-3-[[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]amino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]amino]benzoate Openeye Name: methyl 4-fluoro-3-[[2-(isopropylcarbamoylamino)-2-oxo-ethyl]amino]benzoate CAS Name: 4-fluoro-3-[[2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]amino]benzoate Traditional Name: 4-fluoro-3-[[2-(isopropylcarbamoylamino)-2-keto-ethyl]amino]benzoic acid methyl ester Formula: C14H18FN3O4 MolecularWeight: 311.308823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)CNC1=C(C=CC(=C1)C(=O)OC)F

Isomeric SMILES

CC(C)NC(=O)NC(=O)CNC1=C(C=CC(=C1)C(=O)OC)F

InChI

InChI=1S/C14H18FN3O4/c1-8(2)17-14(21)18-12(19)7-16-11-6-9(13(20)22-3)4-5-10(11)15/h4-6,8,16H,7H2,1-3H3,(H2,17,18,19,21)