N1-ethyl-N1-(2-methoxyethyl)-3-methyl-benzene-1,2-diamine; 4-methylbenzenesulfonic acid

Systemtic Name: N1-ethyl-N1-(2-methoxyethyl)-3-methyl-benzene-1,2-diamine; 4-methylbenzenesulfonic acid Openeye Name: N1-ethyl-N1-(2-methoxyethyl)-3-methyl-benzene-1,2-diamine; 4-methylbenzenesulfonic acid CAS Name: N1-ethyl-N1-(2-methoxyethyl)-3-methylbenzene-1,2-diamine; 4-methylbenzenesulfonic acid IUPAC Name: 1-N-ethyl-1-N-(2-methoxyethyl)-3-methylbenzene-1,2-diamine; 4-methylbenzenesulfonic acid Traditional Name: (2-amino-3-methyl-phenyl)-ethyl-(2-methoxyethyl)amine; tosylic acid Formula: C26H36N2O7S2 MolecularWeight: 552.70324

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCOC)C1=CC=CC(=C1N)C.CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCN(CCOC)C1=CC=CC(=C1N)C.CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C12H20N2O.2C7H8O3S/c1-4-14(8-9-15-3)11-7-5-6-10(2)12(11)13;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-7H,4,8-9,13H2,1-3H3;2*2-5H,1H3,(H,8,9,10)