benzoic acid; 2,5-bis(oxidanyl)benzenesulfonic acid; piperazine

Systemtic Name: benzoic acid; 2,5-bis(oxidanyl)benzenesulfonic acid; piperazine Openeye Name: benzoic acid; 2,5-dihydroxybenzenesulfonic acid; piperazine CAS Name: benzoic acid; 2,5-dihydroxybenzenesulfonic acid; piperazine IUPAC Name: benzoic acid; 2,5-dihydroxybenzenesulfonic acid; piperazine Traditional Name: benzoic acid; 2,5-dihydroxybesylic acid; piperazine Formula: C24H28N2O9S MolecularWeight: 520.55212

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN1.C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)C(=O)O.C1=CC(=C(C=C1O)S(=O)(=O)O)O

Isomeric SMILES

C1CNCCN1.C1=CC=C(C=C1)C(=O)O.C1=CC=C(C=C1)C(=O)O.C1=CC(=C(C=C1O)S(=O)(=O)O)O

InChI

InChI=1S/2C7H6O2.C6H6O5S.C4H10N2/c2*8-7(9)6-4-2-1-3-5-6;7-4-1-2-5(8)6(3-4)12(9,10)11;1-2-6-4-3-5-1/h2*1-5H,(H,8,9);1-3,7-8H,(H,9,10,11);5-6H,1-4H2