3-[2-(dimethylamino)phenyl]propane-1-sulfonate

Systemtic Name: 3-[2-(dimethylamino)phenyl]propane-1-sulfonate Openeye Name: 3-[2-(dimethylamino)phenyl]propane-1-sulfonate CAS Name: 3-[2-(dimethylamino)phenyl]-1-propanesulfonate IUPAC Name: 3-[2-(dimethylamino)phenyl]propane-1-sulfonate Traditional Name: 3-[2-(dimethylamino)phenyl]propane-1-sulfonate Formula: C11H16NO3S- MolecularWeight: 242.31464

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=C1CCCS(=O)(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=CC=C1CCCS(=O)(=O)[O-]

InChI

InChI=1S/C11H17NO3S/c1-12(2)11-8-4-3-6-10(11)7-5-9-16(13,14)15/h3-4,6,8H,5,7,9H2,1-2H3,(H,13,14,15)/p-1