2-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]ethanesulfonic acid

Systemtic Name: 2-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]ethanesulfonic acid Openeye Name: 2-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]ethanesulfonic acid CAS Name: 2-[4-(4-aminophenyl)sulfonyl-1-piperazinyl]ethanesulfonic acid IUPAC Name: 2-[4-(4-aminophenyl)sulfonylpiperazin-1-yl]ethanesulfonic acid Traditional Name: 2-(4-sulfanilylpiperazino)ethanesulfonic acid Formula: C12H19N3O5S2 MolecularWeight: 349.42636

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCS(=O)(=O)O)S(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

C1CN(CCN1CCS(=O)(=O)O)S(=O)(=O)C2=CC=C(C=C2)N

InChI

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