2-[5-azanyl-2-(4-azanylbutylamino)phenyl]sulfonylethanesulfonic acid

Systemtic Name: 2-[5-azanyl-2-(4-azanylbutylamino)phenyl]sulfonylethanesulfonic acid Openeye Name: 2-[5-amino-2-(4-aminobutylamino)phenyl]sulfonylethanesulfonic acid CAS Name: 2-[5-amino-2-(4-aminobutylamino)phenyl]sulfonylethanesulfonic acid IUPAC Name: 2-[5-amino-2-(4-aminobutylamino)phenyl]sulfonylethanesulfonic acid Traditional Name: 2-[5-amino-2-(4-aminobutylamino)phenyl]sulfonylethanesulfonic acid Formula: C12H21N3O5S2 MolecularWeight: 351.44224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)CCS(=O)(=O)O)NCCCCN

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)CCS(=O)(=O)O)NCCCCN

InChI

InChI=1S/C12H21N3O5S2/c13-5-1-2-6-15-11-4-3-10(14)9-12(11)21(16,17)7-8-22(18,19)20/h3-4,9,15H,1-2,5-8,13-14H2,(H,18,19,20)