[4-fluoranyl-2-[[3-oxidanylidene-3-(3-pyridin-4-ylphenyl)propanoyl]amino]phenyl]carbamic acid

Systemtic Name: [4-fluoranyl-2-[[3-oxidanylidene-3-(3-pyridin-4-ylphenyl)propanoyl]amino]phenyl]carbamic acid Openeye Name: [4-fluoro-2-[[3-oxo-3-[3-(4-pyridyl)phenyl]propanoyl]amino]phenyl]carbamic acid CAS Name: [2-[[1,3-dioxo-3-(3-pyridin-4-ylphenyl)propyl]amino]-4-fluorophenyl]carbamic acid IUPAC Name: [4-fluoro-2-[[3-oxo-3-(3-pyridin-4-ylphenyl)propanoyl]amino]phenyl]carbamic acid Traditional Name: [4-fluoro-2-[[3-keto-3-[3-(4-pyridyl)phenyl]propanoyl]amino]phenyl]carbamic acid Formula: C21H16FN3O4 MolecularWeight: 393.367843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)F)NC(=O)O)C3=CC=NC=C3

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CC(=O)NC2=C(C=CC(=C2)F)NC(=O)O)C3=CC=NC=C3

InChI

InChI=1S/C21H16FN3O4/c22-16-4-5-17(25-21(28)29)18(11-16)24-20(27)12-19(26)15-3-1-2-14(10-15)13-6-8-23-9-7-13/h1-11,25H,12H2,(H,24,27)(H,28,29)