3-[(3-oxidanylidenecyclohexen-1-yl)amino]propane-1-sulfonic acid

Systemtic Name: 3-[(3-oxidanylidenecyclohexen-1-yl)amino]propane-1-sulfonic acid Openeye Name: 3-[(3-oxocyclohexen-1-yl)amino]propane-1-sulfonic acid CAS Name: 3-[(3-oxo-1-cyclohexenyl)amino]-1-propanesulfonic acid IUPAC Name: 3-[(3-oxocyclohexen-1-yl)amino]propane-1-sulfonic acid Traditional Name: 3-[(3-ketocyclohexen-1-yl)amino]propane-1-sulfonic acid Formula: C9H15NO4S MolecularWeight: 233.2847

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)NCCCS(=O)(=O)O

Isomeric SMILES

C1CC(=CC(=O)C1)NCCCS(=O)(=O)O

InChI

InChI=1S/C9H15NO4S/c11-9-4-1-3-8(7-9)10-5-2-6-15(12,13)14/h7,10H,1-6H2,(H,12,13,14)