2-[3,5-bis(trifluoromethyl)phenyl]-1-cyano-1-propyl-guanidine

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1-cyano-1-propyl-guanidine Openeye Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1-cyano-1-propyl-guanidine CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1-cyano-1-propylguanidine IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1-cyano-1-propylguanidine Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]-1-cyano-1-propyl-guanidine Formula: C13H12F6N4 MolecularWeight: 338.251599

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C#N)C(=NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N

Isomeric SMILES

CCCN(C#N)C(=NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)N

InChI

InChI=1S/C13H12F6N4/c1-2-3-23(7-20)11(21)22-10-5-8(12(14,15)16)4-9(6-10)13(17,18)19/h4-6H,2-3H2,1H3,(H2,21,22)