5-[(2-azanylethylamino)methyl]-1H-pyrrole-3-sulfonic acid

Systemtic Name: 5-[(2-azanylethylamino)methyl]-1H-pyrrole-3-sulfonic acid Openeye Name: 5-[(2-aminoethylamino)methyl]-1H-pyrrole-3-sulfonic acid CAS Name: 5-[(2-aminoethylamino)methyl]-1H-pyrrole-3-sulfonic acid IUPAC Name: 5-[(2-aminoethylamino)methyl]-1H-pyrrole-3-sulfonic acid Traditional Name: 5-[(2-aminoethylamino)methyl]-1H-pyrrole-3-sulfonic acid Formula: C7H13N3O3S MolecularWeight: 219.26142

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=C1S(=O)(=O)O)CNCCN

Isomeric SMILES

C1=C(NC=C1S(=O)(=O)O)CNCCN

InChI

InChI=1S/C7H13N3O3S/c8-1-2-9-4-6-3-7(5-10-6)14(11,12)13/h3,5,9-10H,1-2,4,8H2,(H,11,12,13)