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sodium 3,5-bis(aminomethyl)benzenesulfonate

sodium 3,5-bis(aminomethyl)benzenesulfonate

Systemtic Name:sodium 3,5-bis(aminomethyl)benzenesulfonate
Openeye Name:sodium 3,5-bis(aminomethyl)benzenesulfonate
CAS Name:sodium 3,5-bis(aminomethyl)benzenesulfonate
IUPAC Name:sodium 3,5-bis(aminomethyl)benzenesulfonate
Traditional Name:sodium 3,5-bis(aminomethyl)besylate
Formula: C8H11N2NaO3S
MolecularWeight: 238.23931
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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1CN)S(=O)(=O)[O-])CN.[Na+]


Isomeric SMILES

C1=C(C=C(C=C1CN)S(=O)(=O)[O-])CN.[Na+]


InChI

InChI=1S/C8H12N2O3S.Na/c9-4-6-1-7(5-10)3-8(2-6)14(11,12)13;/h1-3H,4-5,9-10H2,(H,11,12,13);/q;+1/p-1


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