3-[5-azanyl-2-[(3-azanyl-2-oxidanyl-propyl)amino]phenyl]sulfonylpropanoic acid

Systemtic Name: 3-[5-azanyl-2-[(3-azanyl-2-oxidanyl-propyl)amino]phenyl]sulfonylpropanoic acid Openeye Name: 3-[5-amino-2-[(3-amino-2-hydroxy-propyl)amino]phenyl]sulfonylpropanoic acid CAS Name: 3-[5-amino-2-[(3-amino-2-hydroxypropyl)amino]phenyl]sulfonylpropanoic acid IUPAC Name: 3-[5-amino-2-[(3-amino-2-hydroxypropyl)amino]phenyl]sulfonylpropanoic acid Traditional Name: 3-[5-amino-2-[(3-amino-2-hydroxy-propyl)amino]phenyl]sulfonylpropionic acid Formula: C12H19N3O5S MolecularWeight: 317.36136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)CCC(=O)O)NCC(CN)O

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)CCC(=O)O)NCC(CN)O

InChI

InChI=1S/C12H19N3O5S/c13-6-9(16)7-15-10-2-1-8(14)5-11(10)21(19,20)4-3-12(17)18/h1-2,5,9,15-16H,3-4,6-7,13-14H2,(H,17,18)