N-[1-[(4-azanyl-3-methyl-phenyl)-ethyl-amino]ethyl]methanesulfonamide; sulfuric acid

Systemtic Name: N-[1-[(4-azanyl-3-methyl-phenyl)-ethyl-amino]ethyl]methanesulfonamide; sulfuric acid Openeye Name: N-[1-(4-amino-N-ethyl-3-methyl-anilino)ethyl]methanesulfonamide; sulfuric acid CAS Name: N-[1-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide; sulfuric acid IUPAC Name: N-[1-(4-amino-N-ethyl-3-methylanilino)ethyl]methanesulfonamide; sulfuric acid Traditional Name: N-[1-(4-amino-N-ethyl-3-methyl-anilino)ethyl]methanesulfonamide; sulfuric acid Formula: C60H115N15O30S10 MolecularWeight: 1847.2876

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O

Isomeric SMILES

CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.CCN(C1=CC(=C(C=C1)N)C)C(C)NS(=O)(=O)C.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O.OS(=O)(=O)O

InChI

InChI=1S/5C12H21N3O2S.5H2O4S/c5*1-5-15(10(3)14-18(4,16)17)11-6-7-12(13)9(2)8-11;5*1-5(2,3)4/h5*6-8,10,14H,5,13H2,1-4H3;5*(H2,1,2,3,4)