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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)O

Isomeric SMILES

CC(C(=O)O)NC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)O)O

InChI

InChI=1S/C13H13NO6S/c1-7(13(16)17)14-9-3-2-8-4-10(21(18,19)20)6-12(15)11(8)5-9/h2-7,14-15H,1H3,(H,16,17)(H,18,19,20)