N-[2-(2-methoxyphenoxy)ethyl]hexan-1-amine; naphthalen-2-amine; propane; dihydrate; dihydrochloride

Systemtic Name: N-[2-(2-methoxyphenoxy)ethyl]hexan-1-amine; naphthalen-2-amine; propane; dihydrate; dihydrochloride Openeye Name: N-[2-(2-methoxyphenoxy)ethyl]hexan-1-amine; naphthalen-2-amine; propane; dihydrate; dihydrochloride CAS Name: N-[2-(2-methoxyphenoxy)ethyl]-1-hexanamine; 2-naphthalenamine; propane; dihydrate; dihydrochloride IUPAC Name: N-[2-(2-methoxyphenoxy)ethyl]hexan-1-amine; naphthalen-2-amine; propane; dihydrate; dihydrochloride Traditional Name: hexyl-[2-(2-methoxyphenoxy)ethyl]amine; 2-naphthylamine; n-propane; dihydrate; dihydrochloride Formula: C28H48Cl2N2O4 MolecularWeight: 547.59772

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Descriptors Computed from Structure

Canonical SMILES:

CCC.CCCCCCNCCOC1=CC=CC=C1OC.C1=CC=C2C=C(C=CC2=C1)N.O.O.Cl.Cl

Isomeric SMILES

CCC.CCCCCCNCCOC1=CC=CC=C1OC.C1=CC=C2C=C(C=CC2=C1)N.O.O.Cl.Cl

InChI

InChI=1S/C15H25NO2.C10H9N.C3H8.2ClH.2H2O/c1-3-4-5-8-11-16-12-13-18-15-10-7-6-9-14(15)17-2;11-10-6-5-8-3-1-2-4-9(8)7-10;1-3-2;;;;/h6-7,9-10,16H,3-5,8,11-13H2,1-2H3;1-7H,11H2;3H2,1-2H3;2*1H;2*1H2