[[2-azanyl-1-[3-(diethylamino)phenyl]ethyl]-methylsulfonyl-amino] sulfate

Systemtic Name: [[2-azanyl-1-[3-(diethylamino)phenyl]ethyl]-methylsulfonyl-amino] sulfate Openeye Name: [[2-amino-1-[3-(diethylamino)phenyl]ethyl]-methylsulfonyl-amino] sulfate CAS Name: [[2-amino-1-[3-(diethylamino)phenyl]ethyl]-methylsulfonylamino] sulfate IUPAC Name: [[2-amino-1-[3-(diethylamino)phenyl]ethyl]-methylsulfonylamino] sulfate Traditional Name: [[2-amino-1-[3-(diethylamino)phenyl]ethyl]-mesyl-amino] sulfate Formula: C13H22N3O6S2- MolecularWeight: 380.46028

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=CC(=C1)C(CN)N(OS(=O)(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CCN(CC)C1=CC=CC(=C1)C(CN)N(OS(=O)(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C13H23N3O6S2/c1-4-15(5-2)12-8-6-7-11(9-12)13(10-14)16(23(3,17)18)22-24(19,20)21/h6-9,13H,4-5,10,14H2,1-3H3,(H,19,20,21)/p-1