6-[1-[3-(aminomethyl)cyclohexyl]-1-azanyl-ethyl]-2-methyl-2H-1,4-benzoxazin-3-amine trihydrochloride

Systemtic Name: 6-[1-[3-(aminomethyl)cyclohexyl]-1-azanyl-ethyl]-2-methyl-2H-1,4-benzoxazin-3-amine trihydrochloride Openeye Name: 6-[1-amino-1-[3-(aminomethyl)cyclohexyl]ethyl]-2-methyl-2H-1,4-benzoxazin-3-amine trihydrochloride CAS Name: 6-[1-amino-1-[3-(aminomethyl)cyclohexyl]ethyl]-2-methyl-2H-1,4-benzoxazin-3-amine trihydrochloride IUPAC Name: 6-[1-amino-1-[3-(aminomethyl)cyclohexyl]ethyl]-2-methyl-2H-1,4-benzoxazin-3-amine trihydrochloride Traditional Name: [3-[1-amino-1-(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)ethyl]cyclohexyl]methylamine trihydrochloride Formula: C18H31Cl3N4O MolecularWeight: 425.82394

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NC2=C(O1)C=CC(=C2)C(C)(C3CCCC(C3)CN)N)N.Cl.Cl.Cl

Isomeric SMILES

CC1C(=NC2=C(O1)C=CC(=C2)C(C)(C3CCCC(C3)CN)N)N.Cl.Cl.Cl

InChI

InChI=1S/C18H28N4O.3ClH/c1-11-17(20)22-15-9-14(6-7-16(15)23-11)18(2,21)13-5-3-4-12(8-13)10-19;;;/h6-7,9,11-13H,3-5,8,10,19,21H2,1-2H3,(H2,20,22);3*1H