5-[3-azanyl-1-(1,2-oxazol-3-yl)propyl]-4-chloranyl-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 5-[3-azanyl-1-(1,2-oxazol-3-yl)propyl]-4-chloranyl-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-(3-amino-1-isoxazol-3-yl-propyl)-4-chloro-3-fluoro-6-oxo-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 5-[3-amino-1-(3-isoxazolyl)propyl]-4-chloro-3-fluoro-6-oxo-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 5-[3-amino-1-(1,2-oxazol-3-yl)propyl]-4-chloro-3-fluoro-6-oxocyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-(3-amino-1-isoxazol-3-yl-propyl)-4-chloro-3-fluoro-6-keto-cyclohexa-1,3-diene-1-carbonitrile Formula: C13H11ClFN3O2 MolecularWeight: 295.696743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CON=C1C(CCN)C2C(=C(C=C(C2=O)C#N)F)Cl

Isomeric SMILES

C1=CON=C1C(CCN)C2C(=C(C=C(C2=O)C#N)F)Cl

InChI

InChI=1S/C13H11ClFN3O2/c14-12-9(15)5-7(6-17)13(19)11(12)8(1-3-16)10-2-4-20-18-10/h2,4-5,8,11H,1,3,16H2