2-[2-bromanyl-3-ethyl-5-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)guanidine hydrochloride

Systemtic Name: 2-[2-bromanyl-3-ethyl-5-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)guanidine hydrochloride Openeye Name: 2-[2-bromo-3-ethyl-5-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)guanidine hydrochloride CAS Name: 2-[2-bromo-3-ethyl-5-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)guanidine hydrochloride IUPAC Name: 2-[2-bromo-3-ethyl-5-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)guanidine hydrochloride Traditional Name: 2-[2-bromo-3-ethyl-5-(trifluoromethyl)phenyl]-1-(3-ethylphenyl)guanidine hydrochloride Formula: C18H20BrClF3N3 MolecularWeight: 450.72371

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=NC2=CC(=CC(=C2Br)CC)C(F)(F)F)N.Cl

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=NC2=CC(=CC(=C2Br)CC)C(F)(F)F)N.Cl

InChI

InChI=1S/C18H19BrF3N3.ClH/c1-3-11-6-5-7-14(8-11)24-17(23)25-15-10-13(18(20,21)22)9-12(4-2)16(15)19;/h5-10H,3-4H2,1-2H3,(H3,23,24,25);1H