4-[2-(methylamino)ethylamino]benzenesulfonic acid

Systemtic Name: 4-[2-(methylamino)ethylamino]benzenesulfonic acid Openeye Name: 4-[2-(methylamino)ethylamino]benzenesulfonic acid CAS Name: 4-[2-(methylamino)ethylamino]benzenesulfonic acid IUPAC Name: 4-[2-(methylamino)ethylamino]benzenesulfonic acid Traditional Name: 4-[2-(methylamino)ethylamino]besylic acid Formula: C9H14N2O3S MolecularWeight: 230.28406

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Descriptors Computed from Structure

Canonical SMILES:

CNCCNC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CNCCNC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C9H14N2O3S/c1-10-6-7-11-8-2-4-9(5-3-8)15(12,13)14/h2-5,10-11H,6-7H2,1H3,(H,12,13,14)