phenyl N-cyano-N'-[3-(4-fluorophenyl)propyl]carbamimidate

Systemtic Name: phenyl N-cyano-N'-[3-(4-fluorophenyl)propyl]carbamimidate Openeye Name: 1-cyano-3-[3-(4-fluorophenyl)propyl]-2-phenyl-isourea CAS Name: N-cyano-N'-[3-(4-fluorophenyl)propyl]carbamimidic acid phenyl ester IUPAC Name: phenyl N-cyano-N'-[3-(4-fluorophenyl)propyl]carbamimidate Traditional Name: 1-cyano-3-[3-(4-fluorophenyl)propyl]-2-phenyl-isourea Formula: C17H16FN3O MolecularWeight: 297.326843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=NCCCC2=CC=C(C=C2)F)NC#N

Isomeric SMILES

C1=CC=C(C=C1)OC(=NCCCC2=CC=C(C=C2)F)NC#N

InChI

InChI=1S/C17H16FN3O/c18-15-10-8-14(9-11-15)5-4-12-20-17(21-13-19)22-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12H2,(H,20,21)