6-[[(3-chlorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride

Systemtic Name: 6-[[(3-chlorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride Openeye Name: 6-[[(3-chlorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride CAS Name: 6-[[(3-chlorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride IUPAC Name: 6-[[(3-chlorophenyl)methylamino]methyl]-2-methyl-4H-1,4-benzoxazin-3-amine dihydrochloride Traditional Name: (3-amino-2-methyl-4H-1,4-benzoxazin-6-yl)methyl-(3-chlorobenzyl)amine dihydrochloride Formula: C17H20Cl3N3O MolecularWeight: 388.7192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C(O1)C=CC(=C2)CNCC3=CC(=CC=C3)Cl)N.Cl.Cl

Isomeric SMILES

CC1=C(NC2=C(O1)C=CC(=C2)CNCC3=CC(=CC=C3)Cl)N.Cl.Cl

InChI

InChI=1S/C17H18ClN3O.2ClH/c1-11-17(19)21-15-8-13(5-6-16(15)22-11)10-20-9-12-3-2-4-14(18)7-12;;/h2-8,20-21H,9-10,19H2,1H3;2*1H