4-azanylbenzenesulfonic acid; 3-oxidanylbutanal

Systemtic Name: 4-azanylbenzenesulfonic acid; 3-oxidanylbutanal Openeye Name: 4-aminobenzenesulfonic acid; 3-hydroxybutanal CAS Name: 4-aminobenzenesulfonic acid; 3-hydroxybutanal IUPAC Name: 4-aminobenzenesulfonic acid; 3-hydroxybutanal Traditional Name: 4-aminobesylic acid; 3-hydroxybutyraldehyde Formula: C10H15NO5S MolecularWeight: 261.2948

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)O.C1=CC(=CC=C1N)S(=O)(=O)O

Isomeric SMILES

CC(CC=O)O.C1=CC(=CC=C1N)S(=O)(=O)O

InChI

InChI=1S/C6H7NO3S.C4H8O2/c7-5-1-3-6(4-2-5)11(8,9)10;1-4(6)2-3-5/h1-4H,7H2,(H,8,9,10);3-4,6H,2H2,1H3