N4,N4-diethyl-N2-methyl-benzene-1,2,4-triamine sulfate hydrate

Systemtic Name: N4,N4-diethyl-N2-methyl-benzene-1,2,4-triamine sulfate hydrate Openeye Name: N4,N4-diethyl-N2-methyl-benzene-1,2,4-triamine sulfate hydrate CAS Name: N4,N4-diethyl-N2-methylbenzene-1,2,4-triamine sulfate hydrate IUPAC Name: 4-N,4-N-diethyl-2-N-methylbenzene-1,2,4-triamine sulfate hydrate Traditional Name: [4-amino-3-(methylamino)phenyl]-diethyl-amine sulfate hydrate Formula: C11H21N3O5S-2 MolecularWeight: 307.36654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)N)NC.O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)N)NC.O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C11H19N3.H2O4S.H2O/c1-4-14(5-2)9-6-7-10(12)11(8-9)13-3;1-5(2,3)4;/h6-8,13H,4-5,12H2,1-3H3;(H2,1,2,3,4);1H2/p-2