4-(6-sulfohexylamino)benzoic acid

Systemtic Name: 4-(6-sulfohexylamino)benzoic acid Openeye Name: 4-(6-sulfohexylamino)benzoic acid CAS Name: 4-(6-sulfohexylamino)benzoic acid IUPAC Name: 4-(6-sulfohexylamino)benzoic acid Traditional Name: 4-(6-sulfohexylamino)benzoic acid Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCCCCCCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCCCCCCS(=O)(=O)O

InChI

InChI=1S/C13H19NO5S/c15-13(16)11-5-7-12(8-6-11)14-9-3-1-2-4-10-20(17,18)19/h5-8,14H,1-4,9-10H2,(H,15,16)(H,17,18,19)