N-[4-[(3-azanyl-2-methyl-2H-1,4-benzoxazin-6-yl)methylamino]butyl]-2,2,2-tris(fluoranyl)ethanamide dihydrochloride

Systemtic Name: N-[4-[(3-azanyl-2-methyl-2H-1,4-benzoxazin-6-yl)methylamino]butyl]-2,2,2-tris(fluoranyl)ethanamide dihydrochloride Openeye Name: N-[4-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methylamino]butyl]-2,2,2-trifluoro-acetamide dihydrochloride CAS Name: N-[4-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methylamino]butyl]-2,2,2-trifluoroacetamide dihydrochloride IUPAC Name: N-[4-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methylamino]butyl]-2,2,2-trifluoroacetamide dihydrochloride Traditional Name: N-[4-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methylamino]butyl]-2,2,2-trifluoro-acetamide dihydrochloride Formula: C16H23Cl2F3N4O2 MolecularWeight: 431.28063

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NC2=C(O1)C=CC(=C2)CNCCCCNC(=O)C(F)(F)F)N.Cl.Cl

Isomeric SMILES

CC1C(=NC2=C(O1)C=CC(=C2)CNCCCCNC(=O)C(F)(F)F)N.Cl.Cl

InChI

InChI=1S/C16H21F3N4O2.2ClH/c1-10-14(20)23-12-8-11(4-5-13(12)25-10)9-21-6-2-3-7-22-15(24)16(17,18)19;;/h4-5,8,10,21H,2-3,6-7,9H2,1H3,(H2,20,23)(H,22,24);2*1H