N-phenethylbenzenesulfonamide; propane-1-sulfonate

Systemtic Name: N-phenethylbenzenesulfonamide; propane-1-sulfonate Openeye Name: N-phenethylbenzenesulfonamide; propane-1-sulfonate CAS Name: N-phenethylbenzenesulfonamide; 1-propanesulfonate IUPAC Name: N-phenethylbenzenesulfonamide; propane-1-sulfonate Traditional Name: N-phenethylbenzenesulfonamide; propane-1-sulfonate Formula: C17H22NO5S2- MolecularWeight: 384.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)[O-].C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCS(=O)(=O)[O-].C1=CC=C(C=C1)CCNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H15NO2S.C3H8O3S/c16-18(17,14-9-5-2-6-10-14)15-12-11-13-7-3-1-4-8-13;1-2-3-7(4,5)6/h1-10,15H,11-12H2;2-3H2,1H3,(H,4,5,6)/p-1