5-(3-azido-1-phenyl-propyl)-4-bromanyl-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 5-(3-azido-1-phenyl-propyl)-4-bromanyl-3-fluoranyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-(3-azido-1-phenyl-propyl)-4-bromo-3-fluoro-6-oxo-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 5-(3-azido-1-phenylpropyl)-4-bromo-3-fluoro-6-oxo-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 5-(3-azido-1-phenylpropyl)-4-bromo-3-fluoro-6-oxocyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-(3-azido-1-phenyl-propyl)-4-bromo-3-fluoro-6-keto-cyclohexa-1,3-diene-1-carbonitrile Formula: C16H12BrFN4O MolecularWeight: 375.195083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCN=[N+]=[N-])C2C(=C(C=C(C2=O)C#N)F)Br

Isomeric SMILES

C1=CC=C(C=C1)C(CCN=[N+]=[N-])C2C(=C(C=C(C2=O)C#N)F)Br

InChI

InChI=1S/C16H12BrFN4O/c17-15-13(18)8-11(9-19)16(23)14(15)12(6-7-21-22-20)10-4-2-1-3-5-10/h1-5,8,12,14H,6-7H2