2-azanyl-3-[3,4-bis(oxidanyl)-5-(phenylsulfonyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3,4-bis(oxidanyl)-5-(phenylsulfonyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[3-(benzenesulfonyl)-4,5-dihydroxy-phenyl]propanoic acid CAS Name: 2-amino-3-[3-(benzenesulfonyl)-4,5-dihydroxyphenyl]propanoic acid IUPAC Name: 2-amino-3-[3-(benzenesulfonyl)-4,5-dihydroxyphenyl]propanoic acid Traditional Name: 2-amino-3-(3-besyl-4,5-dihydroxy-phenyl)propionic acid Formula: C15H15NO6S MolecularWeight: 337.3477

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC(=C2O)O)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC(=CC(=C2O)O)CC(C(=O)O)N

InChI

InChI=1S/C15H15NO6S/c16-11(15(19)20)6-9-7-12(17)14(18)13(8-9)23(21,22)10-4-2-1-3-5-10/h1-5,7-8,11,17-18H,6,16H2,(H,19,20)