2-(3-azanyl-2-piperazin-1-yl-phenyl)sulfonylethanesulfonic acid

Systemtic Name: 2-(3-azanyl-2-piperazin-1-yl-phenyl)sulfonylethanesulfonic acid Openeye Name: 2-(3-amino-2-piperazin-1-yl-phenyl)sulfonylethanesulfonic acid CAS Name: 2-[3-amino-2-(1-piperazinyl)phenyl]sulfonylethanesulfonic acid IUPAC Name: 2-(3-amino-2-piperazin-1-ylphenyl)sulfonylethanesulfonic acid Traditional Name: 2-(3-amino-2-piperazino-phenyl)sulfonylethanesulfonic acid Formula: C12H19N3O5S2 MolecularWeight: 349.42636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=CC=C2S(=O)(=O)CCS(=O)(=O)O)N

Isomeric SMILES

C1CN(CCN1)C2=C(C=CC=C2S(=O)(=O)CCS(=O)(=O)O)N

InChI

InChI=1S/C12H19N3O5S2/c13-10-2-1-3-11(12(10)15-6-4-14-5-7-15)21(16,17)8-9-22(18,19)20/h1-3,14H,4-9,13H2,(H,18,19,20)