3,5-bis(aminomethyl)benzenesulfonic acid

Systemtic Name: 3,5-bis(aminomethyl)benzenesulfonic acid Openeye Name: 3,5-bis(aminomethyl)benzenesulfonic acid CAS Name: 3,5-bis(aminomethyl)benzenesulfonic acid IUPAC Name: 3,5-bis(aminomethyl)benzenesulfonic acid Traditional Name: 3,5-bis(aminomethyl)besylic acid Formula: C8H12N2O3S MolecularWeight: 216.25748

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1CN)S(=O)(=O)O)CN

Isomeric SMILES

C1=C(C=C(C=C1CN)S(=O)(=O)O)CN

InChI

InChI=1S/C8H12N2O3S/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)