2-[(E)-1,5-bis(methylamino)pent-1-en-3-yl]oxy-4-chloranyl-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(E)-1,5-bis(methylamino)pent-1-en-3-yl]oxy-4-chloranyl-5-fluoranyl-benzenecarbonitrile Openeye Name: 4-chloro-5-fluoro-2-[(E)-3-(methylamino)-1-[2-(methylamino)ethyl]allyloxy]benzonitrile CAS Name: 2-[(E)-1,5-bis(methylamino)pent-1-en-3-yl]oxy-4-chloro-5-fluorobenzonitrile IUPAC Name: 2-[(E)-1,5-bis(methylamino)pent-1-en-3-yl]oxy-4-chloro-5-fluorobenzonitrile Traditional Name: 4-chloro-5-fluoro-2-[(E)-3-(methylamino)-1-[2-(methylamino)ethyl]allyloxy]benzonitrile Formula: C14H17ClFN3O MolecularWeight: 297.755683

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C=CNC)OC1=CC(=C(C=C1C#N)F)Cl

Isomeric SMILES

CNCCC(/C=C/NC)OC1=CC(=C(C=C1C#N)F)Cl

InChI

InChI=1S/C14H17ClFN3O/c1-18-5-3-11(4-6-19-2)20-14-8-12(15)13(16)7-10(14)9-17/h3,5,7-8,11,18-19H,4,6H2,1-2H3/b5-3+