[2-(3-oxidanylpiperazin-1-yl)-4-propyl-phenyl]sulfamic acid

Systemtic Name: [2-(3-oxidanylpiperazin-1-yl)-4-propyl-phenyl]sulfamic acid Openeye Name: [2-(3-hydroxypiperazin-1-yl)-4-propyl-phenyl]sulfamic acid CAS Name: [2-(3-hydroxy-1-piperazinyl)-4-propylphenyl]sulfamic acid IUPAC Name: [2-(3-hydroxypiperazin-1-yl)-4-propylphenyl]sulfamic acid Traditional Name: [2-(3-hydroxypiperazino)-4-propyl-phenyl]sulfamic acid Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)O

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)O)N2CCNC(C2)O

InChI

InChI=1S/C13H21N3O4S/c1-2-3-10-4-5-11(15-21(18,19)20)12(8-10)16-7-6-14-13(17)9-16/h4-5,8,13-15,17H,2-3,6-7,9H2,1H3,(H,18,19,20)