2-(5-azanyl-2-piperidin-1-yl-phenyl)sulfonylethanesulfonic acid

Systemtic Name: 2-(5-azanyl-2-piperidin-1-yl-phenyl)sulfonylethanesulfonic acid Openeye Name: 2-[5-amino-2-(1-piperidyl)phenyl]sulfonylethanesulfonic acid CAS Name: 2-[5-amino-2-(1-piperidinyl)phenyl]sulfonylethanesulfonic acid IUPAC Name: 2-(5-amino-2-piperidin-1-ylphenyl)sulfonylethanesulfonic acid Traditional Name: 2-(5-amino-2-piperidino-phenyl)sulfonylethanesulfonic acid Formula: C13H20N2O5S2 MolecularWeight: 348.4383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)N)S(=O)(=O)CCS(=O)(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)N)S(=O)(=O)CCS(=O)(=O)O

InChI

InChI=1S/C13H20N2O5S2/c14-11-4-5-12(15-6-2-1-3-7-15)13(10-11)21(16,17)8-9-22(18,19)20/h4-5,10H,1-3,6-9,14H2,(H,18,19,20)