1-(1,2-dihydroacenaphthylen-5-yl)-1-[[4-(trifluoromethyloxy)phenyl]methyl]guanidine

Systemtic Name: 1-(1,2-dihydroacenaphthylen-5-yl)-1-[[4-(trifluoromethyloxy)phenyl]methyl]guanidine Openeye Name: 1-(1,2-dihydroacenaphthylen-5-yl)-1-[[4-(trifluoromethoxy)phenyl]methyl]guanidine CAS Name: 1-(1,2-dihydroacenaphthylen-5-yl)-1-[[4-(trifluoromethoxy)phenyl]methyl]guanidine IUPAC Name: 1-(1,2-dihydroacenaphthylen-5-yl)-1-[[4-(trifluoromethoxy)phenyl]methyl]guanidine Traditional Name: 1-acenaphthen-5-yl-1-[4-(trifluoromethoxy)benzyl]guanidine Formula: C21H18F3N3O MolecularWeight: 385.38233

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)N(CC4=CC=C(C=C4)OC(F)(F)F)C(=N)N

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)N(CC4=CC=C(C=C4)OC(F)(F)F)C(=N)N

InChI

InChI=1S/C21H18F3N3O/c22-21(23,24)28-16-9-4-13(5-10-16)12-27(20(25)26)18-11-8-15-7-6-14-2-1-3-17(18)19(14)15/h1-5,8-11H,6-7,12H2,(H3,25,26)