1-(4-fluorophenyl)-N'-hexadecyl-butane-1,4-diamine dihydrochloride

Systemtic Name: 1-(4-fluorophenyl)-N'-hexadecyl-butane-1,4-diamine dihydrochloride Openeye Name: 1-(4-fluorophenyl)-N'-hexadecyl-butane-1,4-diamine dihydrochloride CAS Name: 1-(4-fluorophenyl)-N'-hexadecylbutane-1,4-diamine dihydrochloride IUPAC Name: 1-(4-fluorophenyl)-N'-hexadecylbutane-1,4-diamine dihydrochloride Traditional Name: [4-amino-4-(4-fluorophenyl)butyl]-cetyl-amine dihydrochloride Formula: C26H49Cl2FN2 MolecularWeight: 479.585063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCCCC(C1=CC=C(C=C1)F)N.Cl.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCNCCCC(C1=CC=C(C=C1)F)N.Cl.Cl

InChI

InChI=1S/C26H47FN2.2ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-29-23-16-17-26(28)24-18-20-25(27)21-19-24;;/h18-21,26,29H,2-17,22-23,28H2,1H3;2*1H