4-(propanoylamino)benzenesulfonic acid

Systemtic Name: 4-(propanoylamino)benzenesulfonic acid Openeye Name: 4-(propanoylamino)benzenesulfonic acid CAS Name: 4-(1-oxopropylamino)benzenesulfonic acid IUPAC Name: 4-(propanoylamino)benzenesulfonic acid Traditional Name: 4-propionamidobesylic acid Formula: C9H11NO4S MolecularWeight: 229.25294

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C9H11NO4S/c1-2-9(11)10-7-3-5-8(6-4-7)15(12,13)14/h3-6H,2H2,1H3,(H,10,11)(H,12,13,14)