3-[(8-oxidanyl-6-sulfo-naphthalen-2-yl)amino]propanoic acid

Systemtic Name: 3-[(8-oxidanyl-6-sulfo-naphthalen-2-yl)amino]propanoic acid Openeye Name: 3-[(8-hydroxy-6-sulfo-2-naphthyl)amino]propanoic acid CAS Name: 3-[(8-hydroxy-6-sulfo-2-naphthalenyl)amino]propanoic acid IUPAC Name: 3-[(8-hydroxy-6-sulfonaphthalen-2-yl)amino]propanoic acid Traditional Name: 3-[(8-hydroxy-6-sulfo-2-naphthyl)amino]propionic acid Formula: C13H13NO6S MolecularWeight: 311.31042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)O)NCCC(=O)O

InChI

InChI=1S/C13H13NO6S/c15-12-7-10(21(18,19)20)5-8-1-2-9(6-11(8)12)14-4-3-13(16)17/h1-2,5-7,14-15H,3-4H2,(H,16,17)(H,18,19,20)