2-[(4-azanyl-3-methyl-phenyl)-ethyl-amino]ethanol sulfate hydrate

Systemtic Name: 2-[(4-azanyl-3-methyl-phenyl)-ethyl-amino]ethanol sulfate hydrate Openeye Name: 2-(4-amino-N-ethyl-3-methyl-anilino)ethanol sulfate hydrate CAS Name: 2-(4-amino-N-ethyl-3-methylanilino)ethanol sulfate hydrate IUPAC Name: 2-(4-amino-N-ethyl-3-methylanilino)ethanol sulfate hydrate Traditional Name: 2-(4-amino-N-ethyl-3-methyl-anilino)ethanol sulfate hydrate Formula: C11H20N2O6S-2 MolecularWeight: 308.3513

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H18N2O.H2O4S.H2O/c1-3-13(6-7-14)10-4-5-11(12)9(2)8-10;1-5(2,3)4;/h4-5,8,14H,3,6-7,12H2,1-2H3;(H2,1,2,3,4);1H2/p-2